AG0033X1

5728-52-9 | 4-Biphenylacetic Acid

AG0033X1

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CAS Number	5728-52-9
Catalog Number	AG0033X1(AGN-PC-0JK6IN)
Chemical Name	4-Biphenylacetic Acid
EC Number	227-233-2
IUPAC Name	2-(4-phenylphenyl)acetic acid
InChI	InChI=1S/C14H12O2/c15-14(16)10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10H2,(H,15,16)
InChI Key	QRZAKQDHEVVFRX-UHFFFAOYSA-N
MDL Number	MFCD00004351
Molecular Formula	C14H12O2
Molecular Weight	212.2439
SMILES	O=C(O)Cc1ccc(cc1)c2ccccc2
UNII	94WNJ5U8L7
Synonyms	3-biphenylylacetic acid, 4-biphenylylacetic acid, biphenylacetic acid, biphenylylacetic acid, biphenylylacetic acid, 14C-labeled, felbinac, Traxam, 4-BIPHENYLACETIC ACID, felbinac, 5728-52-9, 4-Biphenylylacetic acid, Traxam, Dolinac, 4-Carboxymethylbiphenyl, Napageln, p-Biphenylylacetic acid, biphenyl-4-ylacetic acid, 2-(4-phenylphenyl)acetic acid, [1,1'-Biphenyl]-4-acetic acid, Seltouch, Target, Felbinacum [Latin], Felbinaco [Spanish], p-Biphenylacetic acid, Acetic acid, (4-biphenylyl)-, Biphenyl-4-acetic acid, CL 83544, LY 61017, UNII-94WNJ5U8L7, NSC 16284, LJC 10,141, Felbinac [USAN:INN:BAN:JAN], (1,1'-Biphenyl)-4-acetic acid, EINECS 227-233-2, MFCD00004351, BRN 1211592, 4-Biphenylacetic acid, 98%, MLS000069466, 2-(biphenyl-4-yl)acetic acid, 94WNJ5U8L7, L 141, L-141, CHEBI:31597, QRZAKQDHEVVFRX-UHFFFAOYSA-N, [1,1'-Biphenyl]-4-ylacetic acid, LJC-10141, NCGC00016660-01, 2-([1,1'-biphenyl]-4-yl)acetic acid, CL-83544, SMR000059071, CAS-5728-52-9, DSSTox_CID_25389, DSSTox_RID_80846, DSSTox_GSID_45389, 4-Biphenylacetic acid(methoxymethyl)-1,1'-biphenyl, Felbinacum, Felbinaco, 2-{[1,1'-biphenyl]-4-yl}acetic acid, Biphenyl-4-yl-acetic acid, Dolonac, Flexfree, Ledergel, Napagel, Selspot, Sumilu, Zenol EXUM, Felbinac (TN), Dolinac (TN), 4-Biphenylaceticacid, BPAA, EMEC, 4-biphenylacetic-acid, biphenyl-4acetic acid, PubChem2498, PubChem8888, 4-biphenyl acetic acid, 4-biphenyl-acetic acid, ACMC-1AJZU, Opera_ID_534, 4-biphenylyl acetic acid, 4-phenylphenylacetic acid, AC1L1FOZ, Prestwick0_000893, Prestwick1_000893, Prestwick2_000893, Prestwick3_000893, 4-(Carboxymethyl)biphenyl, (4'-biphenyl)acetic acid, (Biphenyl-4-yl)acetic aci, AC1Q74XD, Oprea1_058748, SCHEMBL26084, BSPBio_000706, KSC269I0H, SPBio_002915, 4-[l,l'biphenyl]ylacetic acid, BPBio1_000778, CHEMBL413965, Felbinac (JP17/USAN/INN), ZINC2318, DTXSID0045389, 1,1'-biphenyl-4-ylacetic acid, CTK1G9403, HFN-310, (Biphenyl-4-yl)acetic acid 97%, BDBM223312, HMS1570D08, HMS2097D08, HMS3714D08, Pharmakon1600-01506160, 4BMD-0-0, BCP18699, CS-D1194, HY-B0641, KS-000000EQ, NSC16284, Tox21_110549, ANW-32669, AR1730, CB0113, NSC-16284, NSC760372, SBB056750, STK387569, AKOS000119696, Tox21_110549_1, [1,1'-Biphenyl]-4-ylacetic acid #, AC-8104, AN-8335, AS-2883, CCG-213621, CS-8026, DB07477, MCULE-4188902854, NSC-760372, RP26677, RTR-020009, TRA0092195, NCGC00016660-02, NCGC00016660-03, NCGC00016660-04, NCGC00016660-06, AJ-08159, AK-48354, I326, LS-44025, SC-25914, AB0013622, AB1009312, CL 83,544, DB-022648, ST2405566, TL8003689, TR-020009, AB00384278, FT-0602170, FT-0617678, ST50308310, 28B529, A24060, D01675, M-2068, AB00384278_14, SR-01000003008, I01-1673, SR-01000003008-2, BRD-K91740057-001-16-4, F2191-0076, Felbinac, European Pharmacopoeia (EP) Reference Standard, Olaparib, Felbinac ethyl, Biphenylacetic acid, Felbinac), Felbinac?, Seltouch, Takeda, Biphenylylacetic acid, (p-Biphenyl)ethansaure, 3-biphenylylacetic acid, (4-Biphenyl)acetic acid, (4-Phenylphenyl)ethansaure, D0Y7EM, C14H12O2, [1,1'-Biphenyl]-4-aceticacid, CID3332, Felbinac [USAN:BAN:INN:JAN], BIPHENYL-4-YL-ACETALDEHYDE, SC-51, biphenylylacetic acid, 14C-labeled, trans-4-Pentylcyclohexanecarboxylic acid, ACN-048684, C14-H12-O2, Felbinac, Takeda Chemical Industries Ltd, (1s,4r)-4-pentylcyclohexanecarboxylic acid, B1278, 4-09-00-02520 (Beilstein Handbook Reference), 4-Biphenylacetic acid, 98.5% - 25G 25g, B-2700, C012776, 38289-29-1, 4-(3-(1-(cyclopropanecarbonyl)piperazine-4-carbonyl)-4-fluorobenzyl)phthalazin-1(2H)-one, 110-59-8, 51317-25-0, 763113-22-0, BPA,

Complexity	223
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	212.084g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	212.248g/mol
Monoisotopic Mass	212.084g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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