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Phenylpropanoic acids
Description:
Compounds with a structure containing a benzene ring conjugated to a propanoic acid.
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3-(4-Hydroxy-3，5-dimethoxyphenyl)propanoic AcidCas Number: 14897-78-0 Compound CID: 84681Formula: C11H14O5 Molecular Weight: 226.23IUPAC Name: 3-(4-hydroxy-3,5-dimethoxyphenyl)propanoic acidSMILES: COC1=CC(=CC(=C1O)OC)CCC(=O)OInChIKey: BPPVOXVSMSXBEI-UHFFFAOYSA-NInChI: InChI=1S/C11H14O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h5-6,14H,3-4H2,1-2H3,(H,12,13) -
3-(4-Hydroxy-3，5-dimethylphenyl)propanoic AcidCas Number: 7733-58-6 Compound CID: 10352609Formula: C11H14O3 Molecular Weight: 194.23IUPAC Name: 3-(4-hydroxy-3,5-dimethylphenyl)propanoic acidSMILES: CC1=CC(=CC(=C1O)C)CCC(=O)OInChIKey: ZDRQAOYVLZNSRC-UHFFFAOYSA-NInChI: InChI=1S/C11H14O3/c1-7-5-9(3-4-10(12)13)6-8(2)11(7)14/h5-6,14H,3-4H2,1-2H3,(H,12,13)
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3-((tert-butoxycarbonyl)amino)-3-(3-fluorophenyl)propanoic acidCas Number: 284493-59-0Formula: C14H18FNO4 Molecular Weight: 283.3IUPAC Name: 3-(3-fluorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acidSMILES: CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC(=CC=C1)FInChIKey: IQPQPXUDXQDVMK-UHFFFAOYSA-NInChI: InChI=1S/C14H18FNO4/c1-14(2,3)20-13(19)16-11(8-12(17)18)9-5-4-6-10(15)7-9/h4-7,11H,8H2,1-3H3,(H,16,19)(H,17,18)
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3-(2-Bromo-4，5-Dimethoxyphenyl)PropanoicacidCas Number: 52679-49-9 Compound CID: 285845Formula: C11H13BrO4 Molecular Weight: 289.13IUPAC Name: 3-(2-bromo-4,5-dimethoxyphenyl)propanoic acidSMILES: COC1=C(C=C(C(=C1)CCC(=O)O)Br)OCInChIKey: SJTJBIRPIITRRT-UHFFFAOYSA-NInChI: InChI=1S/C11H13BrO4/c1-15-9-5-7(3-4-11(13)14)8(12)6-10(9)16-2/h5-6H,3-4H2,1-2H3,(H,13,14)
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2-(m-tolyl)propanoic acidCas Number: 73721-06-9 Compound CID: 5249709Formula: C10H12O2 Molecular Weight: 164.2IUPAC Name: 2-(3-methylphenyl)propanoic acidSMILES: CC1=CC(=CC=C1)C(C)C(=O)OInChIKey: ZUWBVWNCAANKGU-UHFFFAOYSA-NInChI: InChI=1S/C10H12O2/c1-7-4-3-5-9(6-7)8(2)10(11)12/h3-6,8H,1-2H3,(H,11,12)
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Boc-beta-Phe(3-Methoxy)-OHCas Number: 284493-53-4Formula: C15H21NO5 Molecular Weight: 295.34IUPAC Name: 3-(3-methoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acidSMILES: CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC(=CC=C1)OCInChIKey: DNXONWHJJNOKEU-UHFFFAOYSA-NInChI: InChI=1S/C15H21NO5/c1-15(2,3)21-14(19)16-12(9-13(17)18)10-6-5-7-11(8-10)20-4/h5-8,12H,9H2,1-4H3,(H,16,19)(H,17,18)
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Boc-3-Amino-3-(2，3-dichlorophenyl)-propionic acidCas Number: 284493-64-7 Compound CID: 2756791Formula: C14H17Cl2NO4 Molecular Weight: 334.2IUPAC Name: 3-(2,3-dichlorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acidSMILES: CC(C)(C)OC(=O)NC(CC(=O)O)C1=C(C(=CC=C1)Cl)ClInChIKey: KGXWCCCBQSYUKL-UHFFFAOYSA-NInChI: InChI=1S/C14H17Cl2NO4/c1-14(2,3)21-13(20)17-10(7-11(18)19)8-5-4-6-9(15)12(8)16/h4-6,10H,7H2,1-3H3,(H,17,20)(H,18,19)
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3-(Trifluoromethoxy)-Benzenepropanoic AcidCas Number: 168833-77-0 Compound CID: 2777288Formula: C10H9F3O3 Molecular Weight: 234.17IUPAC Name: 3-[3-(trifluoromethoxy)phenyl]propanoic acidSMILES: C1=CC(=CC(=C1)OC(F)(F)F)CCC(=O)OInChIKey: WGEVFUNNEITJFQ-UHFFFAOYSA-NInChI: InChI=1S/C10H9F3O3/c11-10(12,13)16-8-3-1-2-7(6-8)4-5-9(14)15/h1-3,6H,4-5H2,(H,14,15)
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3-(4-Ethylphenyl)propanoic acidCas Number: 64740-36-9 Compound CID: 2064039Formula: C11H14O2 Molecular Weight: 178.22IUPAC Name: 3-(4-ethylphenyl)propanoic acidSMILES: CCC1=CC=C(C=C1)CCC(=O)OInChIKey: MUQCDEGKKWQCAO-UHFFFAOYSA-NInChI: InChI=1S/C11H14O2/c1-2-9-3-5-10(6-4-9)7-8-11(12)13/h3-6H,2,7-8H2,1H3,(H,12,13)
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3-(4-Fluoro-3-nitrophenyl)propanoic acidCas Number: 160877-40-7 Compound CID: 10774937Formula: C9H8FNO4 Molecular Weight: 213.16IUPAC Name: 3-(4-fluoro-3-nitrophenyl)propanoic acidSMILES: C1=CC(=C(C=C1CCC(=O)O)[N+](=O)[O-])FInChIKey: IHRNYARREWSFGQ-UHFFFAOYSA-NInChI: InChI=1S/C9H8FNO4/c10-7-3-1-6(2-4-9(12)13)5-8(7)11(14)15/h1,3,5H,2,4H2,(H,12,13)
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3-(4-Acetoxyphenyl)propanoic acidCas Number: 7249-16-3 Compound CID: 237913Formula: C11H12O4 Molecular Weight: 208.21IUPAC Name: 3-(4-acetyloxyphenyl)propanoic acidSMILES: CC(=O)OC1=CC=C(C=C1)CCC(=O)OInChIKey: YQPHNMWXZLUIJX-UHFFFAOYSA-NInChI: InChI=1S/C11H12O4/c1-8(12)15-10-5-2-9(3-6-10)4-7-11(13)14/h2-3,5-6H,4,7H2,1H3,(H,13,14)
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3-(3-Bromophenyl)-3-((tert-butoxycarbonyl)amino)propanoic acidCas Number: 284493-58-9 Compound CID: 2764535Formula: C14H18BrNO4 Molecular Weight: 344.21IUPAC Name: 3-(3-bromophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acidSMILES: CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC(=CC=C1)BrInChIKey: UTYRIGRZLZNTLR-UHFFFAOYSA-NInChI: InChI=1S/C14H18BrNO4/c1-14(2,3)20-13(19)16-11(8-12(17)18)9-5-4-6-10(15)7-9/h4-7,11H,8H2,1-3H3,(H,16,19)(H,17,18)
