Benzol und substituierte Derivate

Benzol ist ein aromatisches organisches Molekül, das aus sechs Kohlenstoffatomen und sechs Wasserstoffatomen besteht, die einen Ring bilden. Darunter substituierte derivative Verbindungen.

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Natriumsalicylat, 99 %, Thermo Scientific Chemicals

CAS: 54-21-7 Summenformel: C7H5NaO3 Molekulargewicht (g/mol): 160.104 MDL-Nummer: MFCD00002440 InChI-Schlüssel: ABBQHOQBGMUPJH-UHFFFAOYSA-M Synonym: sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl PubChem CID: 16760658 ChEBI: CHEBI:9180 IUPAC-Name: Natrium;2-Hydroxybenzoat SMILES: C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]

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InChI-Schlüssel	ABBQHOQBGMUPJH-UHFFFAOYSA-M
IUPAC-Name	Natrium;2-Hydroxybenzoat
PubChem CID	16760658
CAS	54-21-7
ChEBI	CHEBI:9180
MDL-Nummer	MFCD00002440
Molekulargewicht (g/mol)	160.104
SMILES	C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]
Synonym	sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl
Summenformel	C7H5NaO3

Methylsalicylat, 98 %, Thermo Scientific Chemicals

CAS: 119-36-8 Summenformel: C8H8O3 Molekulargewicht (g/mol): 152.149 MDL-Nummer: MFCD00002214 InChI-Schlüssel: OSWPMRLSEDHDFF-UHFFFAOYSA-N Synonym: methyl salicylate,wintergreen oil,gaultheria oil,betula oil,teaberry oil,sweet birch oil,oil of wintergreen,analgit,spicewood oil,2-hydroxybenzoic acid methyl ester PubChem CID: 4133 ChEBI: CHEBI:31832 IUPAC-Name: Methyl 2-Hydroxybenzoat SMILES: COC(=O)C1=CC=CC=C1O

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InChI-Schlüssel	OSWPMRLSEDHDFF-UHFFFAOYSA-N
IUPAC-Name	Methyl 2-Hydroxybenzoat
PubChem CID	4133
CAS	119-36-8
ChEBI	CHEBI:31832
MDL-Nummer	MFCD00002214
Molekulargewicht (g/mol)	152.149
SMILES	COC(=O)C1=CC=CC=C1O
Synonym	methyl salicylate,wintergreen oil,gaultheria oil,betula oil,teaberry oil,sweet birch oil,oil of wintergreen,analgit,spicewood oil,2-hydroxybenzoic acid methyl ester
Summenformel	C8H8O3

4-Aminobenzoesäure, 99 %, Thermo Scientific Chemicals

CAS: 150-13-0 Summenformel: C7H7NO2 Molekulargewicht (g/mol): 137.14 MDL-Nummer: MFCD00007894 InChI-Schlüssel: ALYNCZNDIQEVRV-UHFFFAOYSA-N Synonym: p-aminobenzoic acid,paba,para-aminobenzoic acid,vitamin bx,sunbrella,p-carboxyaniline,4-carboxyaniline,hachemina,paraminol,benzoic acid, 4-amino PubChem CID: 978 ChEBI: CHEBI:30753 IUPAC-Name: 4-Aminobenzoesäure SMILES: NC1=CC=C(C=C1)C(O)=O

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InChI-Schlüssel	ALYNCZNDIQEVRV-UHFFFAOYSA-N
IUPAC-Name	4-Aminobenzoesäure
PubChem CID	978
CAS	150-13-0
ChEBI	CHEBI:30753
MDL-Nummer	MFCD00007894
Molekulargewicht (g/mol)	137.14
SMILES	NC1=CC=C(C=C1)C(O)=O
Synonym	p-aminobenzoic acid,paba,para-aminobenzoic acid,vitamin bx,sunbrella,p-carboxyaniline,4-carboxyaniline,hachemina,paraminol,benzoic acid, 4-amino
Summenformel	C7H7NO2

Methyl 4-Hydroxybenzoat 99 %, Thermo Scientific Chemicals

CAS: 99-76-3 Summenformel: C8H8O3 Molekulargewicht (g/mol): 152.149 MDL-Nummer: MFCD00002352 InChI-Schlüssel: LXCFILQKKLGQFO-UHFFFAOYSA-N Synonym: methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m PubChem CID: 7456 ChEBI: CHEBI:31835 IUPAC-Name: Methyl 4-Hydroxybenzoat SMILES: COC(=O)C1=CC=C(C=C1)O

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InChI-Schlüssel	LXCFILQKKLGQFO-UHFFFAOYSA-N
IUPAC-Name	Methyl 4-Hydroxybenzoat
PubChem CID	7456
CAS	99-76-3
ChEBI	CHEBI:31835
MDL-Nummer	MFCD00002352
Molekulargewicht (g/mol)	152.149
SMILES	COC(=O)C1=CC=C(C=C1)O
Synonym	methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m
Summenformel	C8H8O3

n-Butyl-4-hydroxybenzoat, 99+ %, Thermo Scientific Chemicals

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Benzylalkohol, 99 %, Thermo Scientific Chemicals

CAS: 100-51-6 Summenformel: C7H8O Molekulargewicht (g/mol): 108.14 MDL-Nummer: MFCD00004599,MFCD03792087 InChI-Schlüssel: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC-Name: Phenylmethanol SMILES: OCC1=CC=CC=C1

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InChI-Schlüssel	WVDDGKGOMKODPV-UHFFFAOYSA-N
IUPAC-Name	Phenylmethanol
PubChem CID	244
CAS	100-51-6
ChEBI	CHEBI:17987
MDL-Nummer	MFCD00004599,MFCD03792087
Molekulargewicht (g/mol)	108.14
SMILES	OCC1=CC=CC=C1
Synonym	benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol
Summenformel	C7H8O

Benzylalkohol, 99 %, rein, Thermo Scientific Chemicals

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InChI-Schlüssel	WVDDGKGOMKODPV-UHFFFAOYSA-N
IUPAC-Name	Phenylmethanol
PubChem CID	244
CAS	100-51-6
ChEBI	CHEBI:17987
MDL-Nummer	MFCD00004599,MFCD03792087
Molekulargewicht (g/mol)	108.14
SMILES	OCC1=CC=CC=C1
Synonym	benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol
Summenformel	C7H8O

2-Phenoxyethanol, 99 %, Thermo Scientific Chemicals

CAS: 122-99-6 Summenformel: C₈H₁₀O₂ Molekulargewicht (g/mol): 138.17 MDL-Nummer: MFCD00002857 InChI-Schlüssel: QCDWFXQBSFUVSP-UHFFFAOYSA-N Synonym: phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane PubChem CID: 31236 ChEBI: CHEBI:64275 IUPAC-Name: 2-Phenoxyethanol SMILES: C1=CC=C(C=C1)OCCO

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InChI-Schlüssel	QCDWFXQBSFUVSP-UHFFFAOYSA-N
IUPAC-Name	2-Phenoxyethanol
PubChem CID	31236
CAS	122-99-6
ChEBI	CHEBI:64275
MDL-Nummer	MFCD00002857
Molekulargewicht (g/mol)	138.17
SMILES	C1=CC=C(C=C1)OCCO
Synonym	phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane
Summenformel	C₈H₁₀O₂

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Benzoesäure, 99,6 %, ACS-Reagenz

CAS: 65-85-0 Summenformel: C₇H₆O₂ Molekulargewicht (g/mol): 122.12 InChI-Schlüssel: WPYMKLBDIGXBTP-UHFFFAOYSA-N Synonym: benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv PubChem CID: 243 ChEBI: CHEBI:30746 IUPAC-Name: Benzoesäure SMILES: C1=CC=C(C=C1)C(=O)O

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InChI-Schlüssel	WPYMKLBDIGXBTP-UHFFFAOYSA-N
IUPAC-Name	Benzoesäure
PubChem CID	243
CAS	65-85-0
ChEBI	CHEBI:30746
Molekulargewicht (g/mol)	122.12
SMILES	C1=CC=C(C=C1)C(=O)O
Synonym	benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv
Summenformel	C₇H₆O₂

Benzophenon, 99+ %, rein, Thermo Scientific Chemicals

CAS: 119-61-9 Summenformel: C₁₃H₁₀O Molekulargewicht (g/mol): 182.22 InChI-Schlüssel: RWCCWEUUXYIKHB-UHFFFAOYSA-N Synonym: benzophenone,diphenyl ketone,benzoylbenzene,phenyl ketone,methanone, diphenyl,alpha-oxoditane,ketone, diphenyl,benzene, benzoyl,alpha-oxodiphenylmethane,diphenylketone PubChem CID: 3102 ChEBI: CHEBI:41308 IUPAC-Name: Diphenylmethanon SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC=C2

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InChI-Schlüssel	RWCCWEUUXYIKHB-UHFFFAOYSA-N
IUPAC-Name	Diphenylmethanon
PubChem CID	3102
CAS	119-61-9
ChEBI	CHEBI:41308
Molekulargewicht (g/mol)	182.22
SMILES	C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
Synonym	benzophenone,diphenyl ketone,benzoylbenzene,phenyl ketone,methanone, diphenyl,alpha-oxoditane,ketone, diphenyl,benzene, benzoyl,alpha-oxodiphenylmethane,diphenylketone
Summenformel	C₁₃H₁₀O

1,5-Diphenylcarbazid, ACS, Thermo Scientific Chemicals

CAS: 140-22-7 Summenformel: C13H14N4O Molekulargewicht (g/mol): 242.282 MDL-Nummer: MFCD00003013 InChI-Schlüssel: KSPIHGBHKVISFI-UHFFFAOYSA-N Synonym: 1,5-diphenylcarbazide,diphenylcarbazide,1,5-diphenylcarbohydrazide,carbonic dihydrazide, 2,2'-diphenyl,1,5-diphenylcarbonohydrazide,1,5-diphenylcabohydrazide,sym-diphenylcarbazide,n,n'-diphenylcarbazide,2,2'-diphenylcarbazide,carbohydrazide, 1,5-diphenyl PubChem CID: 8789 ChEBI: CHEBI:4641 IUPAC-Name: 1,3-Dianilinharnstoff SMILES: C1=CC=C(C=C1)NNC(=O)NNC2=CC=CC=C2

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InChI-Schlüssel	KSPIHGBHKVISFI-UHFFFAOYSA-N
IUPAC-Name	1,3-Dianilinharnstoff
PubChem CID	8789
CAS	140-22-7
ChEBI	CHEBI:4641
MDL-Nummer	MFCD00003013
Molekulargewicht (g/mol)	242.282
SMILES	C1=CC=C(C=C1)NNC(=O)NNC2=CC=CC=C2
Synonym	1,5-diphenylcarbazide,diphenylcarbazide,1,5-diphenylcarbohydrazide,carbonic dihydrazide, 2,2'-diphenyl,1,5-diphenylcarbonohydrazide,1,5-diphenylcabohydrazide,sym-diphenylcarbazide,n,n'-diphenylcarbazide,2,2'-diphenylcarbazide,carbohydrazide, 1,5-diphenyl
Summenformel	C13H14N4O

Thermo Scientific Chemicals p-Terphenyl, 99+%

CAS: 92-94-4 Summenformel: C₁₈H₁₄ Molekulargewicht (g/mol): 230.31 MDL-Nummer: MFCD00003061 InChI-Schlüssel: XJKSTNDFUHDPQJ-UHFFFAOYSA-N Synonym: p-terphenyl,1,1':4',1-terphenyl,p-diphenylbenzene,p-triphenyl,santowax p,4-phenylbiphenyl,4-phenyldiphenyl,para-terphenyl,biphenyl, 4-phenyl,pyrogallol tannin PubChem CID: 7115 ChEBI: CHEBI:52242 IUPAC-Name: 1,4-Diphenylbenzol SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3

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InChI-Schlüssel	XJKSTNDFUHDPQJ-UHFFFAOYSA-N
IUPAC-Name	1,4-Diphenylbenzol
PubChem CID	7115
CAS	92-94-4
ChEBI	CHEBI:52242
MDL-Nummer	MFCD00003061
Molekulargewicht (g/mol)	230.31
SMILES	C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3
Synonym	p-terphenyl,1,1':4',1-terphenyl,p-diphenylbenzene,p-triphenyl,santowax p,4-phenylbiphenyl,4-phenyldiphenyl,para-terphenyl,biphenyl, 4-phenyl,pyrogallol tannin
Summenformel	C₁₈H₁₄

Diethylphthalat, 99 %, Thermo Scientific Chemicals

CAS: 84-66-2 Summenformel: C₁₂H₁₄O₄ Molekulargewicht (g/mol): 222.24 MDL-Nummer: MFCD00009111 InChI-Schlüssel: FLKPEMZONWLCSK-UHFFFAOYSA-N Synonym: diethyl phthalate,phthalic acid diethyl ester,ethyl phthalate,anozol,neantine,phthalol,solvanol,diethyl o-phthalate,palatinol a,placidol e PubChem CID: 6781 ChEBI: CHEBI:34698 IUPAC-Name: Diethylbenzol-1,2-Dicarboxylat SMILES: CCOC(=O)C1=CC=CC=C1C(=O)OCC

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InChI-Schlüssel	FLKPEMZONWLCSK-UHFFFAOYSA-N
IUPAC-Name	Diethylbenzol-1,2-Dicarboxylat
PubChem CID	6781
CAS	84-66-2
ChEBI	CHEBI:34698
MDL-Nummer	MFCD00009111
Molekulargewicht (g/mol)	222.24
SMILES	CCOC(=O)C1=CC=CC=C1C(=O)OCC
Synonym	diethyl phthalate,phthalic acid diethyl ester,ethyl phthalate,anozol,neantine,phthalol,solvanol,diethyl o-phthalate,palatinol a,placidol e
Summenformel	C₁₂H₁₄O₄

3,5-Dinitrobenzoesäure, 99 %, Thermo Scientific Chemicals

CAS: 99-34-3 Summenformel: C7H4N2O6 Molekulargewicht (g/mol): 212.12 MDL-Nummer: MFCD00007253 InChI-Schlüssel: VYWYYJYRVSBHJQ-UHFFFAOYSA-N Synonym: 3,5-dinitrobenzoic acid,dinitrobenzoic acid,dnba,benzoic acid, 3,5-dinitro,3-carboxy-1,5-dinitrobenzene,3,5-dinitro-benzoic acid,unii-4v3f9q018p,ccris 3129,3,5-dnba,3,5-dinitrobenzenecarboxylic acid PubChem CID: 7433 ChEBI: CHEBI:73914 IUPAC-Name: 3,5-Dinitrobenzoesäure SMILES: OC(=O)C1=CC(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O

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InChI-Schlüssel	VYWYYJYRVSBHJQ-UHFFFAOYSA-N
IUPAC-Name	3,5-Dinitrobenzoesäure
PubChem CID	7433
CAS	99-34-3
ChEBI	CHEBI:73914
MDL-Nummer	MFCD00007253
Molekulargewicht (g/mol)	212.12
SMILES	OC(=O)C1=CC(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O
Synonym	3,5-dinitrobenzoic acid,dinitrobenzoic acid,dnba,benzoic acid, 3,5-dinitro,3-carboxy-1,5-dinitrobenzene,3,5-dinitro-benzoic acid,unii-4v3f9q018p,ccris 3129,3,5-dnba,3,5-dinitrobenzenecarboxylic acid
Summenformel	C7H4N2O6

Benzyltriethylammoniumchlorid, 99 %, Thermo Scientific Chemicals

CAS: 56-37-1 Summenformel: C13H22ClN Molekulargewicht (g/mol): 227.78 MDL-Nummer: MFCD00011824 InChI-Schlüssel: HTZCNXWZYVXIMZ-UHFFFAOYSA-M Synonym: benzyltriethylammonium chloride,tebac,benzyl triethylammonium chloride,benzyl triethyl ammonium chloride,benzyltriethylammoniumchloride,triethylbenzylammonium chloride,bteac,teba,benzyltriethylazanium chloride,n-benzyl-n,n-diethylethanaminium chloride PubChem CID: 66133 IUPAC-Name: Benzyl(trimethyl)azanium;chlorid SMILES: [Cl-].CC[N+](CC)(CC)CC1=CC=CC=C1

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InChI-Schlüssel	HTZCNXWZYVXIMZ-UHFFFAOYSA-M
IUPAC-Name	Benzyl(trimethyl)azanium;chlorid
PubChem CID	66133
CAS	56-37-1
MDL-Nummer	MFCD00011824
Molekulargewicht (g/mol)	227.78
SMILES	[Cl-].CC[N+](CC)(CC)CC1=CC=CC=C1
Synonym	benzyltriethylammonium chloride,tebac,benzyl triethylammonium chloride,benzyl triethyl ammonium chloride,benzyltriethylammoniumchloride,triethylbenzylammonium chloride,bteac,teba,benzyltriethylazanium chloride,n-benzyl-n,n-diethylethanaminium chloride
Summenformel	C13H22ClN

Benzol und substituierte Derivate

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