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Phenylpropansäuren

Organische Verbindungen, die aus einer Carbonsäure mit folgender Formel bestehen: C9H10O2; auch als Hydrocinnaminsäure bezeichnet. Sie vorwiegend in der Kosmetik, als Lebensmittelzusatzstoffe und in der pharmazeutischen Industrie verwendet.

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1

3-Phenylpropionsäure, 99 %, Thermo Scientific Chemicals

CAS: 501-52-0 Summenformel: C9H10O2 Molekulargewicht (g/mol): 150.177 MDL-Nummer: MFCD00002771 InChI-Schlüssel: XMIIGOLPHOKFCH-UHFFFAOYSA-N Synonym: hydrocinnamic acid,3-phenylpropionic acid,benzylacetic acid,benzenepropanoic acid,dihydrocinnamic acid,benzenepropionic acid,phenylpropanoic acid,3-phenyl-propionic acid,phenylpropanoate,beta-phenylpropionic acid PubChem CID: 107 ChEBI: CHEBI:28631 IUPAC-Name: 3-Phenylpropansäure SMILES: C1=CC=C(C=C1)CCC(=O)O

InChI-Schlüssel XMIIGOLPHOKFCH-UHFFFAOYSA-N
IUPAC-Name 3-Phenylpropansäure
PubChem CID 107
CAS 501-52-0
ChEBI CHEBI:28631
MDL-Nummer MFCD00002771
Molekulargewicht (g/mol) 150.177
SMILES C1=CC=C(C=C1)CCC(=O)O
Synonym hydrocinnamic acid,3-phenylpropionic acid,benzylacetic acid,benzenepropanoic acid,dihydrocinnamic acid,benzenepropionic acid,phenylpropanoic acid,3-phenyl-propionic acid,phenylpropanoate,beta-phenylpropionic acid
Summenformel C9H10O2
2

3-(3,4-Dimethoxyphenyl)propionsäure, 98 %, Thermo Scientific Chemicals

CAS: 2107-70-2 Summenformel: C11H14O4 Molekulargewicht (g/mol): 210.229 MDL-Nummer: MFCD00002774 InChI-Schlüssel: LHHKQWQTBCTDQM-UHFFFAOYSA-N Synonym: 3-3,4-dimethoxyphenyl propionic acid,3-3,4-dimethoxyphenyl propanoic acid,3,4-dimethoxyhydrocinnamic acid,benzenepropanoic acid, 3,4-dimethoxy,3-3,4-dimethoxyphenyl-propionic acid,3-3,4-dimethoxy-phenyl-propionic acid,unii-6xo32zsp1d,6xo32zsp1d,3-3',4'-dimethoxyphenyl propanoic acid,3-3,4-dimethoxyphenyl propionicacid PubChem CID: 75019 ChEBI: CHEBI:44235 IUPAC-Name: 3-(3,4-Dimethoxyphenyl)propansäure SMILES: COC1=C(C=C(C=C1)CCC(=O)O)OC

InChI-Schlüssel LHHKQWQTBCTDQM-UHFFFAOYSA-N
IUPAC-Name 3-(3,4-Dimethoxyphenyl)propansäure
PubChem CID 75019
CAS 2107-70-2
ChEBI CHEBI:44235
MDL-Nummer MFCD00002774
Molekulargewicht (g/mol) 210.229
SMILES COC1=C(C=C(C=C1)CCC(=O)O)OC
Synonym 3-3,4-dimethoxyphenyl propionic acid,3-3,4-dimethoxyphenyl propanoic acid,3,4-dimethoxyhydrocinnamic acid,benzenepropanoic acid, 3,4-dimethoxy,3-3,4-dimethoxyphenyl-propionic acid,3-3,4-dimethoxy-phenyl-propionic acid,unii-6xo32zsp1d,6xo32zsp1d,3-3',4'-dimethoxyphenyl propanoic acid,3-3,4-dimethoxyphenyl propionicacid
Summenformel C11H14O4
3

Thermo Scientific Chemicals DL-2-Benzylserin, 97 %

CAS: 4740-47-0 Summenformel: C10H13NO3 Molekulargewicht (g/mol): 195.22 MDL-Nummer: MFCD01863305 InChI-Schlüssel: ZMNNAJIBOJDHAF-JTQLQIEISA-N Synonym: dl-2-benzylserine,2-amino-3-hydroxy-2-benzylpropanoic acid,alpha-benzyl-dl-serine PubChem CID: 7010088 IUPAC-Name: (2S)-2-Amino-2-benzyl-3-hydroxypropansäure SMILES: C1=CC=C(C=C1)CC(CO)(C(=O)O)N

InChI-Schlüssel ZMNNAJIBOJDHAF-JTQLQIEISA-N
IUPAC-Name (2S)-2-Amino-2-benzyl-3-hydroxypropansäure
PubChem CID 7010088
CAS 4740-47-0
MDL-Nummer MFCD01863305
Molekulargewicht (g/mol) 195.22
SMILES C1=CC=C(C=C1)CC(CO)(C(=O)O)N
Synonym dl-2-benzylserine,2-amino-3-hydroxy-2-benzylpropanoic acid,alpha-benzyl-dl-serine
Summenformel C10H13NO3
4

3-(4-Hydroxy-3-Methoxyphenyl)propionsäure, 97 %, Thermo Scientific Chemicals

CAS: 1135-23-5 Summenformel: C10H12O4 Molekulargewicht (g/mol): 196.202 MDL-Nummer: MFCD00016558 InChI-Schlüssel: BOLQJTPHPSDZHR-UHFFFAOYSA-N Synonym: 3-4-hydroxy-3-methoxyphenyl propanoic acid,3-4-hydroxy-3-methoxyphenyl propionic acid,dihydroferulic acid,hydroferulic acid,dihydroconiferylic acid,unii-o01rnc700m,benzenepropanoic acid, 4-hydroxy-3-methoxy,3-4-hydroxymethyl propionic acid,.beta.-4-hydroxy-3-methoxyphenyl propionic acid,3-4-hydroxy-3-methoxy-phenyl propanoic acid PubChem CID: 14340 ChEBI: CHEBI:86612 IUPAC-Name: 3-(4-Hydroxy-3-Methoxyphenyl)propionsäure SMILES: COC1=C(C=CC(=C1)CCC(=O)O)O

InChI-Schlüssel BOLQJTPHPSDZHR-UHFFFAOYSA-N
IUPAC-Name 3-(4-Hydroxy-3-Methoxyphenyl)propionsäure
PubChem CID 14340
CAS 1135-23-5
ChEBI CHEBI:86612
MDL-Nummer MFCD00016558
Molekulargewicht (g/mol) 196.202
SMILES COC1=C(C=CC(=C1)CCC(=O)O)O
Synonym 3-4-hydroxy-3-methoxyphenyl propanoic acid,3-4-hydroxy-3-methoxyphenyl propionic acid,dihydroferulic acid,hydroferulic acid,dihydroconiferylic acid,unii-o01rnc700m,benzenepropanoic acid, 4-hydroxy-3-methoxy,3-4-hydroxymethyl propionic acid,.beta.-4-hydroxy-3-methoxyphenyl propionic acid,3-4-hydroxy-3-methoxy-phenyl propanoic acid
Summenformel C10H12O4
5

3-(4-Bromophenyl)Propionsäure, 97 %, Thermo Scientific Chemicals

CAS: 1643-30-7 MDL-Nummer: MFCD01310793 InChI-Schlüssel: NCSTWHYWOVZDOC-UHFFFAOYSA-N Synonym: 3-4-bromophenyl propionic acid,3-4-bromophenyl propanoic acid,benzenepropanoic acid, 4-bromo,3-4-bromo-phenyl-propionic acid,p-bromohydrocinnamic acid,3-4-bromophenyl-propionic acid,3-4-bromophenyl propanoicacid,pubchem19769,4-bromohydrocinnamic acid,acmc-1c0vm PubChem CID: 2735609 IUPAC-Name: 3-(4-Trichlorphenoxy)Propansäure SMILES: C1=CC(=CC=C1CCC(=O)O)Br

InChI-Schlüssel NCSTWHYWOVZDOC-UHFFFAOYSA-N
IUPAC-Name 3-(4-Trichlorphenoxy)Propansäure
PubChem CID 2735609
CAS 1643-30-7
MDL-Nummer MFCD01310793
SMILES C1=CC(=CC=C1CCC(=O)O)Br
Synonym 3-4-bromophenyl propionic acid,3-4-bromophenyl propanoic acid,benzenepropanoic acid, 4-bromo,3-4-bromo-phenyl-propionic acid,p-bromohydrocinnamic acid,3-4-bromophenyl-propionic acid,3-4-bromophenyl propanoicacid,pubchem19769,4-bromohydrocinnamic acid,acmc-1c0vm
6

DL-2-Phenylpropionsäure, 98 %, Thermo Scientific Chemicals

CAS: 492-37-5 MDL-Nummer: MFCD00002650 InChI-Schlüssel: YPGCWEMNNLXISK-UHFFFAOYSA-N Synonym: 2-phenylpropionic acid,hydratropic acid,dl-2-phenylpropionic acid,alpha-methylphenylacetic acid,2-phenyl-propionic acid,+/--2-phenylpropionic acid,alpha-methylbenzeneacetic acid,benzeneacetic acid, .alpha.-methyl,hydratropasaeure,alpha-phenylpropionic acid PubChem CID: 10296 ChEBI: CHEBI:48526 IUPAC-Name: 2-Phenylpropansäure SMILES: CC(C1=CC=CC=C1)C(=O)O

InChI-Schlüssel YPGCWEMNNLXISK-UHFFFAOYSA-N
IUPAC-Name 2-Phenylpropansäure
PubChem CID 10296
CAS 492-37-5
ChEBI CHEBI:48526
MDL-Nummer MFCD00002650
SMILES CC(C1=CC=CC=C1)C(=O)O
Synonym 2-phenylpropionic acid,hydratropic acid,dl-2-phenylpropionic acid,alpha-methylphenylacetic acid,2-phenyl-propionic acid,+/--2-phenylpropionic acid,alpha-methylbenzeneacetic acid,benzeneacetic acid, .alpha.-methyl,hydratropasaeure,alpha-phenylpropionic acid
7

3-(4-Hydroxyphenyl)propionsäure, 98 %, Thermo Scientific Chemicals

CAS: 501-97-3 Summenformel: C9H10O3 Molekulargewicht (g/mol): 166.18 MDL-Nummer: MFCD00002778 InChI-Schlüssel: NMHMNPHRMNGLLB-UHFFFAOYSA-N Synonym: 3-4-hydroxyphenyl propionic acid,phloretic acid,3-4-hydroxyphenyl propanoic acid,desaminotyrosine,hydro-p-coumaric acid,dihydro-p-coumaric acid,benzenepropanoic acid, 4-hydroxy,4-hydroxyphenylpropionic acid,p-hydroxyhydrocinnamic acid,3-p-hydroxyphenyl propionic acid PubChem CID: 10394 ChEBI: CHEBI:32980 IUPAC-Name: 3-(4-Hydroxyphenyl)propansäure SMILES: C1=CC(=CC=C1CCC(=O)O)O

InChI-Schlüssel NMHMNPHRMNGLLB-UHFFFAOYSA-N
IUPAC-Name 3-(4-Hydroxyphenyl)propansäure
PubChem CID 10394
CAS 501-97-3
ChEBI CHEBI:32980
MDL-Nummer MFCD00002778
Molekulargewicht (g/mol) 166.18
SMILES C1=CC(=CC=C1CCC(=O)O)O
Synonym 3-4-hydroxyphenyl propionic acid,phloretic acid,3-4-hydroxyphenyl propanoic acid,desaminotyrosine,hydro-p-coumaric acid,dihydro-p-coumaric acid,benzenepropanoic acid, 4-hydroxy,4-hydroxyphenylpropionic acid,p-hydroxyhydrocinnamic acid,3-p-hydroxyphenyl propionic acid
Summenformel C9H10O3
8

4-(Trifluoromethyl)Hydrozimtsäure, 95 %, Thermo Scientific Chemicals

CAS: 53473-36-2 Summenformel: C10H9F3O2 Molekulargewicht (g/mol): 218.17 MDL-Nummer: MFCD00674032 InChI-Schlüssel: OEIUMLSCWINLBB-UHFFFAOYSA-N Synonym: 4-trifluoromethyl hydrocinnamic acid,3-4-trifluoromethyl phenyl propanoic acid,3-4-trifluoromethyl phenyl propionic acid,benzenepropanoic acid, 4-trifluoromethyl,3-4-trifluoromethylphenyl propionic acid,4-trifluoromethyl phenylpropionic acid,p-trifluoromethyl benzylacetic acid,3-4-trifluoromethyl-phenyl-propionic acid PubChem CID: 3588736 IUPAC-Name: 3-[4-(Trifluormethyl)phenyl]propansäure SMILES: C1=CC(=CC=C1CCC(=O)O)C(F)(F)F

InChI-Schlüssel OEIUMLSCWINLBB-UHFFFAOYSA-N
IUPAC-Name 3-[4-(Trifluormethyl)phenyl]propansäure
PubChem CID 3588736
CAS 53473-36-2
MDL-Nummer MFCD00674032
Molekulargewicht (g/mol) 218.17
SMILES C1=CC(=CC=C1CCC(=O)O)C(F)(F)F
Synonym 4-trifluoromethyl hydrocinnamic acid,3-4-trifluoromethyl phenyl propanoic acid,3-4-trifluoromethyl phenyl propionic acid,benzenepropanoic acid, 4-trifluoromethyl,3-4-trifluoromethylphenyl propionic acid,4-trifluoromethyl phenylpropionic acid,p-trifluoromethyl benzylacetic acid,3-4-trifluoromethyl-phenyl-propionic acid
Summenformel C10H9F3O2
9

Hydroxyzimtsäure, 99 %, Thermo Scientific Chemicals

CAS: 501-52-0 Summenformel: C9H10O2 Molekulargewicht (g/mol): 150.18 MDL-Nummer: MFCD00002771 InChI-Schlüssel: XMIIGOLPHOKFCH-UHFFFAOYSA-N Synonym: hydrocinnamic acid,3-phenylpropionic acid,benzylacetic acid,benzenepropanoic acid,dihydrocinnamic acid,benzenepropionic acid,phenylpropanoic acid,3-phenyl-propionic acid,phenylpropanoate,beta-phenylpropionic acid PubChem CID: 107 ChEBI: CHEBI:28631 IUPAC-Name: 3-Phenylpropansäure SMILES: C1=CC=C(C=C1)CCC(=O)O

InChI-Schlüssel XMIIGOLPHOKFCH-UHFFFAOYSA-N
IUPAC-Name 3-Phenylpropansäure
PubChem CID 107
CAS 501-52-0
ChEBI CHEBI:28631
MDL-Nummer MFCD00002771
Molekulargewicht (g/mol) 150.18
SMILES C1=CC=C(C=C1)CCC(=O)O
Synonym hydrocinnamic acid,3-phenylpropionic acid,benzylacetic acid,benzenepropanoic acid,dihydrocinnamic acid,benzenepropionic acid,phenylpropanoic acid,3-phenyl-propionic acid,phenylpropanoate,beta-phenylpropionic acid
Summenformel C9H10O2
10

DL-Phenylbernsteinsäure, 98+%

CAS: 635-51-8 Summenformel: C10H10O4 Molekulargewicht (g/mol): 194.19 MDL-Nummer: MFCD00004256 InChI-Schlüssel: LVFFZQQWIZURIO-UHFFFAOYSA-N Synonym: phenylsuccinic acid,dl-phenylsuccinic acid,2-phenylsuccinic acid,phenyl succinic acid,butanedioic acid, phenyl,succinic acid, phenyl,2-phenylsuccinate,.alpha.-phenylsuccinic acid,phenylsuccinate,butanedioic acid, 2-phenyl PubChem CID: 95459 IUPAC-Name: 2-Phenylbutandisäure SMILES: C1=CC=C(C=C1)C(CC(=O)O)C(=O)O

InChI-Schlüssel LVFFZQQWIZURIO-UHFFFAOYSA-N
IUPAC-Name 2-Phenylbutandisäure
PubChem CID 95459
CAS 635-51-8
MDL-Nummer MFCD00004256
Molekulargewicht (g/mol) 194.19
SMILES C1=CC=C(C=C1)C(CC(=O)O)C(=O)O
Synonym phenylsuccinic acid,dl-phenylsuccinic acid,2-phenylsuccinic acid,phenyl succinic acid,butanedioic acid, phenyl,succinic acid, phenyl,2-phenylsuccinate,.alpha.-phenylsuccinic acid,phenylsuccinate,butanedioic acid, 2-phenyl
Summenformel C10H10O4
12

3-(4-Nitrophenyl)-Propansäure, 98 %, Thermo Scientific Chemicals

CAS: 16642-79-8 Summenformel: C9H9NO4 Molekulargewicht (g/mol): 195.17 MDL-Nummer: MFCD00126834 InChI-Schlüssel: VZOPVJNBOQOLPN-UHFFFAOYSA-N Synonym: 3-4-nitrophenyl propanoic acid,3-4-nitrophenyl propionic acid,benzenepropanoic acid, 4-nitro,3-4-nitrophenyl-propionic acid,4-nitrobenzenepropanoic acid,p-nitrohydrozimtsaure,pubchem13615,p-nitrohydrocinnamic acid PubChem CID: 85526 IUPAC-Name: 3-(4-Nitrophenyl)propansäure SMILES: OC(=O)CCC1=CC=C(C=C1)[N+]([O-])=O

InChI-Schlüssel VZOPVJNBOQOLPN-UHFFFAOYSA-N
IUPAC-Name 3-(4-Nitrophenyl)propansäure
PubChem CID 85526
CAS 16642-79-8
MDL-Nummer MFCD00126834
Molekulargewicht (g/mol) 195.17
SMILES OC(=O)CCC1=CC=C(C=C1)[N+]([O-])=O
Synonym 3-4-nitrophenyl propanoic acid,3-4-nitrophenyl propionic acid,benzenepropanoic acid, 4-nitro,3-4-nitrophenyl-propionic acid,4-nitrobenzenepropanoic acid,p-nitrohydrozimtsaure,pubchem13615,p-nitrohydrocinnamic acid
Summenformel C9H9NO4
13

3-(2,4-Dichlorphenyl)Propansäure, 97 %, Thermo Scientific™

CAS: 55144-92-8 Summenformel: C9H8Cl2O2 Molekulargewicht (g/mol): 219.061 MDL-Nummer: MFCD00275605 InChI-Schlüssel: HLNPVFSCAMKIOD-UHFFFAOYSA-N PubChem CID: 2740915 IUPAC-Name: 3-(2,4-Dichlorphenyl)propansäure SMILES: C1=CC(=C(C=C1Cl)Cl)CCC(=O)O

InChI-Schlüssel HLNPVFSCAMKIOD-UHFFFAOYSA-N
IUPAC-Name 3-(2,4-Dichlorphenyl)propansäure
PubChem CID 2740915
CAS 55144-92-8
MDL-Nummer MFCD00275605
Molekulargewicht (g/mol) 219.061
SMILES C1=CC(=C(C=C1Cl)Cl)CCC(=O)O
Summenformel C9H8Cl2O2