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Pyrazole

Organische heterozyklische Verbindungen, die aus einem fünfgliedrigen Ring aus drei Kohlenstoffatomen und zwei benachbarten Stickstoffatomen mit folgender Formel bestehen: C₃H₃Nâ‚‚H.

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1

5-Brom-7-Methyl-1H-Indazol, 97 %, Thermo Scientific Chemicals

CAS: 156454-43-2 Summenformel: C8H7BrN2 Molekulargewicht (g/mol): 211.062 MDL-Nummer: MFCD03990484 InChI-Schlüssel: OUNQFZFHLJLFAR-UHFFFAOYSA-N PubChem CID: 1382033 IUPAC-Name: 5-Brom-7-methyl-1H-indazol SMILES: CC1=C2C(=CC(=C1)Br)C=NN2

InChI-Schlüssel OUNQFZFHLJLFAR-UHFFFAOYSA-N
IUPAC-Name 5-Brom-7-methyl-1H-indazol
PubChem CID 1382033
CAS 156454-43-2
MDL-Nummer MFCD03990484
Molekulargewicht (g/mol) 211.062
SMILES CC1=C2C(=CC(=C1)Br)C=NN2
Summenformel C8H7BrN2
2

5-Nitro-1H-indazol, ≥ 98 %, Thermo Scientific Chemicals

CAS: 5401-94-5 Summenformel: C7H5N3O2 Molekulargewicht (g/mol): 163.136 MDL-Nummer: MFCD00005693 InChI-Schlüssel: WSGURAYTCUVDQL-UHFFFAOYSA-N Synonym: 5-nitroindazole,1h-indazole, 5-nitro,unii-235y7p37zd,ccris 4134,2h-indazole, 5-nitro,5ni,5-nitroindazol,5-nitro indazole,5-nitro-indazole,5-nitro-1h-indazol PubChem CID: 21501 IUPAC-Name: 5-Nitro-1H-Indazol SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C=NN2

InChI-Schlüssel WSGURAYTCUVDQL-UHFFFAOYSA-N
IUPAC-Name 5-Nitro-1H-Indazol
PubChem CID 21501
CAS 5401-94-5
MDL-Nummer MFCD00005693
Molekulargewicht (g/mol) 163.136
SMILES C1=CC2=C(C=C1[N+](=O)[O-])C=NN2
Synonym 5-nitroindazole,1h-indazole, 5-nitro,unii-235y7p37zd,ccris 4134,2h-indazole, 5-nitro,5ni,5-nitroindazol,5-nitro indazole,5-nitro-indazole,5-nitro-1h-indazol
Summenformel C7H5N3O2
3

5-(Chlormethyl)-1,3-dimethyl-1h-pyrazol, 97 %, Thermo Scientific™

CAS: 852227-86-2 Summenformel: C6H9ClN2 Molekulargewicht (g/mol): 144.60 MDL-Nummer: MFCD07368502 InChI-Schlüssel: SGEZKPNUNBVVLB-UHFFFAOYSA-N PubChem CID: 4961270 SMILES: CN1N=C(C)C=C1CCl

InChI-Schlüssel SGEZKPNUNBVVLB-UHFFFAOYSA-N
PubChem CID 4961270
CAS 852227-86-2
MDL-Nummer MFCD07368502
Molekulargewicht (g/mol) 144.60
SMILES CN1N=C(C)C=C1CCl
Summenformel C6H9ClN2
4

1H-Pyrazol-3-boronsäure Hydrat, 95 %, Thermo Scientific Chemicals

CAS: 376584-63-3 Summenformel: C3H5BN2O2 Molekulargewicht (g/mol): 111.90 MDL-Nummer: MFCD07368247 MFCD02020768 InChI-Schlüssel: NEUWPDLMDVINSN-UHFFFAOYSA-N Synonym: 1h-pyrazol-3-yl boronic acid,pyrazole-3-boronic acid,1h-pyrazol-3-ylboronic acid,1h-pyrazole-3-boronic acid,1h-pyrazole-5-boronic acid,1h-pyrazol-5-yl boronic acid,1h-pyrazol-5-yl-5-boronic acid,pyrazol-3-ylboronic acid,2h-pyrazol-3-ylboronic acid PubChem CID: 11251979 IUPAC-Name: 1H-Pyrazol-5-ylboronsäure SMILES: OB(O)C1=NNC=C1

InChI-Schlüssel NEUWPDLMDVINSN-UHFFFAOYSA-N
IUPAC-Name 1H-Pyrazol-5-ylboronsäure
PubChem CID 11251979
CAS 376584-63-3
MDL-Nummer MFCD07368247 MFCD02020768
Molekulargewicht (g/mol) 111.90
SMILES OB(O)C1=NNC=C1
Synonym 1h-pyrazol-3-yl boronic acid,pyrazole-3-boronic acid,1h-pyrazol-3-ylboronic acid,1h-pyrazole-3-boronic acid,1h-pyrazole-5-boronic acid,1h-pyrazol-5-yl boronic acid,1h-pyrazol-5-yl-5-boronic acid,pyrazol-3-ylboronic acid,2h-pyrazol-3-ylboronic acid
Summenformel C3H5BN2O2
5

1-Methyl-1H-Indazol-3-carbaldehyd, 97 %, Thermo Scientific™

CAS: 4002-83-9 Summenformel: C9H8N2O Molekulargewicht (g/mol): 160.18 MDL-Nummer: MFCD08060478 InChI-Schlüssel: KYDLGYCLCFKUHY-UHFFFAOYSA-N Synonym: 1-methyl-1h-indazole-3-carbaldehyde,1-methyl-1h-indazole-3-carboxaldehyde,3-formyl-1-methyl-1h-indazole,1-methyl-3-formylindazole,1h-indazole-3-carboxaldehyde,1-methyl PubChem CID: 7164545 IUPAC-Name: 1-Methylindazol-3-Carbaldehyd SMILES: CN1N=C(C=O)C2=CC=CC=C12

InChI-Schlüssel KYDLGYCLCFKUHY-UHFFFAOYSA-N
IUPAC-Name 1-Methylindazol-3-Carbaldehyd
PubChem CID 7164545
CAS 4002-83-9
MDL-Nummer MFCD08060478
Molekulargewicht (g/mol) 160.18
SMILES CN1N=C(C=O)C2=CC=CC=C12
Synonym 1-methyl-1h-indazole-3-carbaldehyde,1-methyl-1h-indazole-3-carboxaldehyde,3-formyl-1-methyl-1h-indazole,1-methyl-3-formylindazole,1h-indazole-3-carboxaldehyde,1-methyl
Summenformel C9H8N2O
6

1-Methyl-1H-pyrazol-5-ylamin, 97 %, Thermo Scientific™

CAS: 1192-21-8 Summenformel: C4H7N3 Molekulargewicht (g/mol): 97.121 MDL-Nummer: MFCD00068156 InChI-Schlüssel: JESRNIJXVIFVOV-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazol-5-amine,1-methyl-1h-pyrazol-5-ylamine,1-methyl-5-aminopyrazole,5-amino-1-methylpyrazole,5-amino-1-methyl-1h-pyrazole,1h-pyrazol-5-amine, 1-methyl,2-methyl-2h-pyrazol-3-ylamine,5-amino-1-methyl-pyrazole,2-methyl-2h-pyrazol-3-amine,1-methylpyrazole-5-ylamine PubChem CID: 136927 IUPAC-Name: 2-Methylpyrazol-3-Amin SMILES: CN1C(=CC=N1)N

InChI-Schlüssel JESRNIJXVIFVOV-UHFFFAOYSA-N
IUPAC-Name 2-Methylpyrazol-3-Amin
PubChem CID 136927
CAS 1192-21-8
MDL-Nummer MFCD00068156
Molekulargewicht (g/mol) 97.121
SMILES CN1C(=CC=N1)N
Synonym 1-methyl-1h-pyrazol-5-amine,1-methyl-1h-pyrazol-5-ylamine,1-methyl-5-aminopyrazole,5-amino-1-methylpyrazole,5-amino-1-methyl-1h-pyrazole,1h-pyrazol-5-amine, 1-methyl,2-methyl-2h-pyrazol-3-ylamine,5-amino-1-methyl-pyrazole,2-methyl-2h-pyrazol-3-amine,1-methylpyrazole-5-ylamine
Summenformel C4H7N3
7

6-Iod-1H-indazol, 97 %, Thermo Scientific™

CAS: 261953-36-0 Summenformel: C7H5IN2 Molekulargewicht (g/mol): 244.03 MDL-Nummer: MFCD04114695 InChI-Schlüssel: RSGAXJZKQDNFEP-UHFFFAOYSA-N Synonym: 6-iodoindazole,1h-indazole, 6-iodo,6-iodo 1h indazole,6-iodo-indazole,pubchem18081,indazole, 6-iodo PubChem CID: 12991241 IUPAC-Name: 6-Iod-1H-Indazol SMILES: C1=CC2=C(C=C1I)NN=C2

InChI-Schlüssel RSGAXJZKQDNFEP-UHFFFAOYSA-N
IUPAC-Name 6-Iod-1H-Indazol
PubChem CID 12991241
CAS 261953-36-0
MDL-Nummer MFCD04114695
Molekulargewicht (g/mol) 244.03
SMILES C1=CC2=C(C=C1I)NN=C2
Synonym 6-iodoindazole,1h-indazole, 6-iodo,6-iodo 1h indazole,6-iodo-indazole,pubchem18081,indazole, 6-iodo
Summenformel C7H5IN2
8

1H-Indazol-7-carboxylsäure, 97 %, Thermo Scientific Chemicals

CAS: 677304-69-7 Summenformel: C8H6N2O2 Molekulargewicht (g/mol): 162.15 MDL-Nummer: MFCD06804572 InChI-Schlüssel: WBCWIQCXHSXMDH-UHFFFAOYSA-N Synonym: 7-carboxy-1h-indazole,1h-indazole-7-carboxylicacid,indazole-7-carboxylic acid,7-indazole carboxylic acid,pubchem17673,acmc-1bl1h,ksc351o8t,2h-indazole-7-carboxylic acid,7-1h indazole carboxylic acid PubChem CID: 12639205 IUPAC-Name: 1H-Indazol-7-Carbonsäure SMILES: C1=CC2=C(C(=C1)C(=O)O)NN=C2

InChI-Schlüssel WBCWIQCXHSXMDH-UHFFFAOYSA-N
IUPAC-Name 1H-Indazol-7-Carbonsäure
PubChem CID 12639205
CAS 677304-69-7
MDL-Nummer MFCD06804572
Molekulargewicht (g/mol) 162.15
SMILES C1=CC2=C(C(=C1)C(=O)O)NN=C2
Synonym 7-carboxy-1h-indazole,1h-indazole-7-carboxylicacid,indazole-7-carboxylic acid,7-indazole carboxylic acid,pubchem17673,acmc-1bl1h,ksc351o8t,2h-indazole-7-carboxylic acid,7-1h indazole carboxylic acid
Summenformel C8H6N2O2
9

1,3-Dimethyl-1H-pyrazol-5-amin, 97 %, Thermo Scientific™

CAS: 3524-32-1 Summenformel: C5H9N3 Molekulargewicht (g/mol): 111.148 MDL-Nummer: MFCD00051651 InChI-Schlüssel: ZFDGMMZLXSFNFU-UHFFFAOYSA-N Synonym: 5-amino-1,3-dimethylpyrazole,1,3-dimethyl-1h-pyrazol-5-amine,1,3-dimethyl-1h-pyrazole-5yl-amine,1h-pyrazol-5-amine, 1,3-dimethyl,3-amino-2,5-dimethyl-2h-pyrazole,2,5-dimethyl-2h-pyrazol-3-ylamine,5-amino-1,3-dimethyl pyrazole,1,3-dimethyl-1h-pyrazole-5-amine,5-amino-1,3-dimethyl-1h-pyrazole,1,3-dimethyl-5-aminopyrazole PubChem CID: 520721 IUPAC-Name: 2,5-Dimethylpyrazol-3-Amin SMILES: CC1=NN(C(=C1)N)C

InChI-Schlüssel ZFDGMMZLXSFNFU-UHFFFAOYSA-N
IUPAC-Name 2,5-Dimethylpyrazol-3-Amin
PubChem CID 520721
CAS 3524-32-1
MDL-Nummer MFCD00051651
Molekulargewicht (g/mol) 111.148
SMILES CC1=NN(C(=C1)N)C
Synonym 5-amino-1,3-dimethylpyrazole,1,3-dimethyl-1h-pyrazol-5-amine,1,3-dimethyl-1h-pyrazole-5yl-amine,1h-pyrazol-5-amine, 1,3-dimethyl,3-amino-2,5-dimethyl-2h-pyrazole,2,5-dimethyl-2h-pyrazol-3-ylamine,5-amino-1,3-dimethyl pyrazole,1,3-dimethyl-1h-pyrazole-5-amine,5-amino-1,3-dimethyl-1h-pyrazole,1,3-dimethyl-5-aminopyrazole
Summenformel C5H9N3
10

1-Methyl-5-phenoxy-3-(trifluormethyl)-1H-pyrazol-4-carbaldehyd, 97 %, Thermo Scientific™

CAS: 109925-42-0 Summenformel: C12H9F3N2O2 Molekulargewicht (g/mol): 270.211 MDL-Nummer: MFCD01936001 InChI-Schlüssel: JDLPKSIFGPLXAU-UHFFFAOYSA-N Synonym: 1-methyl-5-phenoxy-3-trifluoromethyl-1h-pyrazole-4-carbaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl pyrazole-4-carbaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl-1h-pyrazole-4-carboxaldehyde,1h-pyrazole-4-carboxaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl,acmc-20a3tk,methylphenoxytrifluoromethylpyrazolecarbaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl-1h-pyrazole-4-carboxyaldehyde PubChem CID: 2775493 IUPAC-Name: 1-Methyl-5-Phenoxy-3-(Trifluormethyl)Pyrazol-4-Carbaldehyd SMILES: CN1C(=C(C(=N1)C(F)(F)F)C=O)OC2=CC=CC=C2

InChI-Schlüssel JDLPKSIFGPLXAU-UHFFFAOYSA-N
IUPAC-Name 1-Methyl-5-Phenoxy-3-(Trifluormethyl)Pyrazol-4-Carbaldehyd
PubChem CID 2775493
CAS 109925-42-0
MDL-Nummer MFCD01936001
Molekulargewicht (g/mol) 270.211
SMILES CN1C(=C(C(=N1)C(F)(F)F)C=O)OC2=CC=CC=C2
Synonym 1-methyl-5-phenoxy-3-trifluoromethyl-1h-pyrazole-4-carbaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl pyrazole-4-carbaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl-1h-pyrazole-4-carboxaldehyde,1h-pyrazole-4-carboxaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl,acmc-20a3tk,methylphenoxytrifluoromethylpyrazolecarbaldehyde,1-methyl-5-phenoxy-3-trifluoromethyl-1h-pyrazole-4-carboxyaldehyde
Summenformel C12H9F3N2O2
11

5-Nitro-1H-Pyrazol, 90 %, Thermo Scientific™

CAS: 26621-44-3 Summenformel: C3H3N3O2 Molekulargewicht (g/mol): 113.08 MDL-Nummer: MFCD00159621,MFCD00238787 InChI-Schlüssel: MZRUFMBFIKGOAL-UHFFFAOYSA-N Synonym: 3-nitro-1h-pyrazole,3-nitropyrazole,1h-pyrazole, 3-nitro,3-nitro-2h-pyrazole,nitropyrazole,pyrazole, 3-nitro,5-nitro-1h-pyrazol,djw 94,djw-94,5-nitropyrazole PubChem CID: 123419 IUPAC-Name: 5-Nitro-1-H-Pyrazol SMILES: [O-][N+](=O)C1=CC=NN1

InChI-Schlüssel MZRUFMBFIKGOAL-UHFFFAOYSA-N
IUPAC-Name 5-Nitro-1-H-Pyrazol
PubChem CID 123419
CAS 26621-44-3
MDL-Nummer MFCD00159621,MFCD00238787
Molekulargewicht (g/mol) 113.08
SMILES [O-][N+](=O)C1=CC=NN1
Synonym 3-nitro-1h-pyrazole,3-nitropyrazole,1h-pyrazole, 3-nitro,3-nitro-2h-pyrazole,nitropyrazole,pyrazole, 3-nitro,5-nitro-1h-pyrazol,djw 94,djw-94,5-nitropyrazole
Summenformel C3H3N3O2
12

(1,5-Dimethyl-1H-pyrazol-3-yl)-methanol, 97 %, Thermo Scientific™

CAS: 153912-60-8 Summenformel: C6H10N2O Molekulargewicht (g/mol): 126.159 MDL-Nummer: MFCD03659702 InChI-Schlüssel: XJBMHIHXRARJJS-UHFFFAOYSA-N Synonym: 1,5-dimethyl-1h-pyrazol-3-yl methanol,1,5-dimethyl-1h-pyrazol-3-yl-methanol,1,5-dimethylpyrazol-3-yl methanol,3-hydroxymethyl-1,5-dimethyl-1h-pyrazole,1h-pyrazole-3-methanol,1,5-dimethyl,1,5-dimethyl-3-hydroxymethyl-1h-pyrazole,1,5-dimethyl-3-hydroxymethyl pyrazole,akos pao-0060,acmc-1cisl,1,5-dimethylpyrazole-3-methanol PubChem CID: 2776366 IUPAC-Name: (1,5-Dimethylpyrazol-3-yl)methanol SMILES: CC1=CC(=NN1C)CO

InChI-Schlüssel XJBMHIHXRARJJS-UHFFFAOYSA-N
IUPAC-Name (1,5-Dimethylpyrazol-3-yl)methanol
PubChem CID 2776366
CAS 153912-60-8
MDL-Nummer MFCD03659702
Molekulargewicht (g/mol) 126.159
SMILES CC1=CC(=NN1C)CO
Synonym 1,5-dimethyl-1h-pyrazol-3-yl methanol,1,5-dimethyl-1h-pyrazol-3-yl-methanol,1,5-dimethylpyrazol-3-yl methanol,3-hydroxymethyl-1,5-dimethyl-1h-pyrazole,1h-pyrazole-3-methanol,1,5-dimethyl,1,5-dimethyl-3-hydroxymethyl-1h-pyrazole,1,5-dimethyl-3-hydroxymethyl pyrazole,akos pao-0060,acmc-1cisl,1,5-dimethylpyrazole-3-methanol
Summenformel C6H10N2O