Phenylpropanoic acids

Ibuprofen, 99%, ACROS Organics™

CAS: 15687-27-1 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.27 InChI Key: HEFNNWSXXWATRW-UHFFFAOYSA-N Synonym: 2-4-isobutylphenyl propanoic acid PubChem CID: 3672 ChEBI: CHEBI:5855 IUPAC Name: 2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

Alfa Aesar™ 3-(4-Formylphenyl)propionic acid, 96%

CAS: 34961-64-3 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.187 MDL Number: MFCD08234824 InChI Key: NRCCSDVEUWXOMG-UHFFFAOYSA-N Synonym: 3-4-formyl-phenyl-propionic acid PubChem CID: 19825241 IUPAC Name: 3-(4-formylphenyl)propanoic acid SMILES: C1=CC(=CC=C1CCC(=O)O)C=O

Alfa Aesar™ 3-(3-Hydroxyphenyl)propionic acid, 98+%

CAS: 621-54-5 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00016554 InChI Key: QVWAEZJXDYOKEH-UHFFFAOYSA-N Synonym: 3-3-hydroxyphenyl propanoic acid PubChem CID: 91 ChEBI: CHEBI:1427 IUPAC Name: 3-(3-hydroxyphenyl)propanoic acid SMILES: C1=CC(=CC(=C1)O)CCC(=O)O

Alfa Aesar™ 3-(3,4-Dihydroxyphenyl)propionic acid, 98+%

CAS: 1078-61-1 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.175 MDL Number: MFCD00002776 InChI Key: DZAUWHJDUNRCTF-UHFFFAOYSA-N Synonym: 3,4-dihydroxybenzenepropionic acid PubChem CID: 348154 ChEBI: CHEBI:48400 IUPAC Name: 3-(3,4-dihydroxyphenyl)propanoic acid SMILES: C1=CC(=C(C=C1CCC(=O)O)O)O

(S)-(+)-Ibuprofen, 99%, ACROS Organics™

CAS: 51146-56-6 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.28 MDL Number: MFCD00069289 InChI Key: HEFNNWSXXWATRW-JTQLQIEISA-N Synonym: +-s-p-isobutylhydratropic acid PubChem CID: 39912 ChEBI: CHEBI:43415 IUPAC Name: (2S)-2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

2-[(Acetylthio)methyl]-3-phenylpropionic Acid 98.0+%, TCI America™

CAS: 91702-98-6 Molecular Formula: C12H14O3S Molecular Weight (g/mol): 238.301 MDL Number: MFCD00236751 InChI Key: BCAAXVOKLXDSPD-UHFFFAOYSA-N PubChem CID: 9991796 IUPAC Name: 2-(acetylsulfanylmethyl)-3-phenylpropanoic acid SMILES: CC(=O)SCC(CC1=CC=CC=C1)C(=O)O

Carbidopa monohydrate, 99%, Acros Organics™

CAS: 38821-49-7 Molecular Formula: C10H14N2O4·H2O Molecular Weight (g/mol): 244.25 InChI Key: QTAOMKOIBXZKND-PPHPATTJSA-N Synonym: +-2-3,4-dihydroxybenzyl-2-hydrazinopropionic acid monohydrate PubChem CID: 38101 ChEBI: CHEBI:3395 IUPAC Name: (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid;hydrate SMILES: CC(CC1=CC(=C(C=C1)O)O)(C(=O)O)NN.O

AM 4668, Tocris Bioscience™ Available on GSA/VA Contract for Federal Government customers only.

CAS: 1011531-27-3 Molecular Formula: C24H19F3N2O4S Molecular Weight (g/mol): 488.481 InChI Key: BMLGZNVPWRUVNM-IBGZPJMESA-N Synonym: ?s-?-4-4-methyl-2-4-trifluoromethyl phenyl-5-thiazolyl methoxy phenyl-3-isoxazolepropanoic acid PubChem CID: 24897670 IUPAC Name: (3S)-3-[4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methoxy]phenyl]-3-(1,2-oxazol-3-yl)propanoic acid SMILES: CC1=C(SC(=N1)C2=CC=C(C=C2)C(F)(F)F)COC3=CC=C(C=C3)C(CC(=O)O)C4=NOC=C4

Alfa Aesar™ 4-Isobutyl-alpha-methylphenylacetic acid, 99%

CAS: 15687-27-1 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00010393 InChI Key: HEFNNWSXXWATRW-UHFFFAOYSA-N Synonym: 2-4-isobutylphenyl propanoic acid PubChem CID: 3672 ChEBI: CHEBI:5855 IUPAC Name: 2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

2-(4-Isobutylphenyl)propionic Acid 98.0+%, TCI America™

CAS: 15687-27-1 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00010393 InChI Key: HEFNNWSXXWATRW-UHFFFAOYSA-N Synonym: 2-4-isobutylphenyl propanoic acid PubChem CID: 3672 ChEBI: CHEBI:5855 IUPAC Name: 2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

TUG 891, Tocris Bioscience™ Available on GSA/VA Contract for Federal Government customers only.

CAS: 1374516-07-0 Molecular Formula: C23H21FO3 Molecular Weight (g/mol): 364.416 InChI Key: LPGBXHWIQNZEJB-UHFFFAOYSA-N Synonym: 3-4-4-fluoro-4'-methylbiphenyl-2-yl methoxy phenyl propanoic acid PubChem CID: 57522038 IUPAC Name: 3-[4-[[5-fluoro-2-(4-methylphenyl)phenyl]methoxy]phenyl]propanoic acid SMILES: CC1=CC=C(C=C1)C2=C(C=C(C=C2)F)COC3=CC=C(C=C3)CCC(=O)O

(S)-α-Methyltyrosine, 98%, 98% ee, ACROS Organics™

CAS: 672-87-7 Molecular Formula: C10H13NO3 Molecular Weight (g/mol): 195.218 InChI Key: NHTGHBARYWONDQ-JTQLQIEISA-N Synonym: alpha-methyl-l-tyrosine PubChem CID: 441350 ChEBI: CHEBI:6912 IUPAC Name: (2S)-2-amino-3-(4-hydroxyphenyl)-2-methylpropanoic acid SMILES: CC(CC1=CC=C(C=C1)O)(C(=O)O)N

Loxoprofen Sodium Salt Dihydrate 98.0+%, TCI America™

CAS: 226721-96-6 Molecular Formula: C15H21NaO5 Molecular Weight (g/mol): 304.318 MDL Number: MFCD01745788 InChI Key: BAZQYVYVKYOAGO-UHFFFAOYSA-M Synonym: Sodium 2-[4-[(2-Oxocyclopentyl)methyl]phenyl]propionate, 2-[4-[(2-Oxocyclopentyl)methyl]phenyl]propionic Acid Sodium Salt PubChem CID: 23674745 ChEBI: CHEBI:31786 IUPAC Name: sodium;2-[4-[(2-oxocyclopentyl)methyl]phenyl]propanoate;dihydrate SMILES: CC(C1=CC=C(C=C1)CC2CCCC2=O)C(=O)[O-].O.O.[Na+]

Hydrocinnamic Acid 99%, ACROS Organics™

CAS: 501-52-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00002771 InChI Key: XMIIGOLPHOKFCH-UHFFFAOYSA-N Synonym: 3-phenyl-propionic acid PubChem CID: 107 ChEBI: CHEBI:28631 IUPAC Name: 3-phenylpropanoic acid SMILES: C1=CC=C(C=C1)CCC(=O)O

Ibuprofen, USP, 97-103%, Spectrum™

CAS: 15687-27-1 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.29 InChI Key: HEFNNWSXXWATRW-UHFFFAOYNA-N IUPAC Name: 2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(O)=O

Alfa Aesar™ 3-(4-Hydroxy-3-methoxyphenyl)propionic acid, 97%

CAS: 1135-23-5 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 MDL Number: MFCD00016558 InChI Key: BOLQJTPHPSDZHR-UHFFFAOYSA-N Synonym: .beta.-4-hydroxy-3-methoxyphenyl propionic acid PubChem CID: 14340 ChEBI: CHEBI:86612 IUPAC Name: 3-(4-hydroxy-3-methoxyphenyl)propanoic acid SMILES: COC1=C(C=CC(=C1)CCC(=O)O)O

Alfa Aesar™ 3-Phenylpropionic acid, 99%

CAS: 501-52-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00002771 InChI Key: XMIIGOLPHOKFCH-UHFFFAOYSA-N Synonym: 3-phenyl-propionic acid PubChem CID: 107 ChEBI: CHEBI:28631 IUPAC Name: 3-phenylpropanoic acid SMILES: C1=CC=C(C=C1)CCC(=O)O

3-[4-(Methylsulfonyl)phenyl]propionic acid, 96%, Alfa Aesar™

CAS: 387350-46-1 Molecular Formula: C10H12O4S Molecular Weight (g/mol): 228.262 MDL Number: MFCD01319236 InChI Key: ZZZBVBATZOAPQB-UHFFFAOYSA-N Synonym: 3-4-methanesulfonylphenyl propanoic acid PubChem CID: 2736960 IUPAC Name: 3-(4-methylsulfonylphenyl)propanoic acid SMILES: CS(=O)(=O)C1=CC=C(C=C1)CCC(=O)O

Alfa Aesar™ 3-(4-Hydroxyphenyl)propionic acid, 99%

CAS: 501-97-3 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00002778 InChI Key: NMHMNPHRMNGLLB-UHFFFAOYSA-N Synonym: 3-4-hydroxyphenyl propanoic acid PubChem CID: 10394 ChEBI: CHEBI:32980 IUPAC Name: 3-(4-hydroxyphenyl)propanoic acid SMILES: C1=CC(=CC=C1CCC(=O)O)O

Alfa Aesar™ 3-(4-Ethoxyphenyl)propionic acid, 98%

CAS: 4919-34-0 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00016557 InChI Key: ZDSHOEQSCJOGCK-UHFFFAOYSA-N Synonym: 3-4-ethoxy-phenyl-propionic acid PubChem CID: 291985 IUPAC Name: 3-(4-ethoxyphenyl)propanoic acid SMILES: CCOC1=CC=C(C=C1)CCC(=O)O

3-(4-Hydroxy-3-methoxyphenyl)propionic Acid 98.0+%, TCI America™

CAS: 1135-23-5 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 InChI Key: BOLQJTPHPSDZHR-UHFFFAOYSA-N Synonym: .beta.-4-hydroxy-3-methoxyphenyl propionic acid PubChem CID: 14340 ChEBI: CHEBI:86612 IUPAC Name: 3-(4-hydroxy-3-methoxyphenyl)propanoic acid SMILES: COC1=C(C=CC(=C1)CCC(=O)O)O

3-(4-Hydroxyphenyl)propionic acid, 98%, ACROS Organics™

CAS: 501-97-3 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00002778 InChI Key: NMHMNPHRMNGLLB-UHFFFAOYSA-N Synonym: 3-4-hydroxyphenyl propanoic acid PubChem CID: 10394 ChEBI: CHEBI:32980 IUPAC Name: 3-(4-hydroxyphenyl)propanoic acid SMILES: C1=CC(=CC=C1CCC(=O)O)O

3-(2-Bromophenyl)propionic Acid 98.0+%, TCI America™

CAS: 15115-58-9 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD01310791 InChI Key: AOACQJFIGWNQBC-UHFFFAOYSA-N Synonym: 2-bromobenzenepropionic acid PubChem CID: 316010 IUPAC Name: 3-(2-bromophenyl)propanoic acid SMILES: C1=CC=C(C(=C1)CCC(=O)O)Br

3-Phenylpropionic Acid 98.0+%, TCI America™

CAS: 501-52-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00002771 InChI Key: XMIIGOLPHOKFCH-UHFFFAOYSA-N Synonym: 3-phenyl-propionic acid PubChem CID: 107 ChEBI: CHEBI:28631 IUPAC Name: 3-phenylpropanoic acid SMILES: C1=CC=C(C=C1)CCC(=O)O

3-(4-Nitrophenyl)propionic Acid 98.0+%, TCI America™

CAS: 16642-79-8 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.174 MDL Number: MFCD00126834 InChI Key: VZOPVJNBOQOLPN-UHFFFAOYSA-N Synonym: 3-4-nitrophenyl propanoic acid PubChem CID: 85526 SMILES: C1=CC(=CC=C1CCC(=O)O)[N+](=O)[O-]

(S)-(+)-2-(4-Isobutylphenyl)propionic Acid 98.0+%, TCI America™

CAS: 51146-56-6 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00069289 InChI Key: HEFNNWSXXWATRW-JTQLQIEISA-N Synonym: +-s-p-isobutylhydratropic acid PubChem CID: 39912 ChEBI: CHEBI:43415 IUPAC Name: (2S)-2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

DL-2-Phenylpropionic Acid 98.0+%, TCI America™

CAS: 492-37-5 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00002650 InChI Key: YPGCWEMNNLXISK-UHFFFAOYSA-N Synonym: +/--2-phenylpropionic acid PubChem CID: 10296 ChEBI: CHEBI:48526 IUPAC Name: 2-phenylpropanoic acid SMILES: CC(C1=CC=CC=C1)C(=O)O

Alfa Aesar™ 3-(3-Fluoro-4-methylphenyl)propionic acid, 97%

CAS: 881189-62-4 Molecular Formula: C10H11FO2 Molecular Weight (g/mol): 182.194 MDL Number: MFCD09025364 InChI Key: DYVQAEHNFXNAEH-UHFFFAOYSA-N Synonym: 3-3-fluoro-4-methyl-phenyl-propionic acid PubChem CID: 46737500 IUPAC Name: 3-(3-fluoro-4-methylphenyl)propanoic acid SMILES: CC1=C(C=C(C=C1)CCC(=O)O)F

Alfa Aesar™ 3-(Boc-amino)-3-(3-methoxyphenyl)propionic acid, 99%

CAS: 284493-53-4 Molecular Formula: C15H21NO5 Molecular Weight (g/mol): 295.335 MDL Number: MFCD02090693 InChI Key: DNXONWHJJNOKEU-UHFFFAOYSA-N Synonym: 3-3-methoxyphenyl-3-2-methylpropan-2-yl oxycarbonylamino propanoic acid PubChem CID: 2734591 IUPAC Name: 3-(3-methoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid SMILES: CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC(=CC=C1)OC

Alfa Aesar™ 2-Benzyl-N-Boc-L-proline, 95%

CAS: 706806-60-2 Molecular Formula: C17H23NO4 Molecular Weight (g/mol): 305.374 MDL Number: MFCD06795522 InChI Key: JUUNPRGYFCIXSM-QGZVFWFLSA-N Synonym: 2-benzyl-1-tert-butoxycarbonyl proline PubChem CID: 2761823 IUPAC Name: (2R)-2-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid SMILES: CC(C)(C)OC(=O)N1CCCC1(CC2=CC=CC=C2)C(=O)O

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