AG003K3T

589-06-0 | 4-(4-Fluorophenyl)butanoic acid

AG003K3T

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CAS Number	589-06-0
Catalog Number	AG003K3T(AGN-PC-0JL8IN)
Chemical Name	4-(4-Fluorophenyl)butanoic acid
EC Number	209-631-8
IUPAC Name	4-(4-fluorophenyl)butanoic acid
InChI	InChI=1S/C10H11FO2/c11-9-6-4-8(5-7-9)2-1-3-10(12)13/h4-7H,1-3H2,(H,12,13)
InChI Key	XVQYBBYOYJXQBF-UHFFFAOYSA-N
MDL Number	MFCD03788503
Molecular Formula	C10H11FO2
Molecular Weight	182.1915
NSC Number	409583
SMILES	O=C(O)CCCC1=CC=C(F)C=C1
Synonyms	4-(4-fluorophenyl)butanoic acid, 589-06-0, 4-(4-fluorophenyl)butyric acid, 4-(p-Fluorophenyl)butyric acid, benzenebutanoic acid, 4-fluoro-, 4-(4-Fluoro-phenyl)-butyric acid, MFCD03788503, 4-(4-fluorophenyl)butanoicacid, EINECS 209-631-8, NSC409583, ACMC-1AWZU, AC1Q4NRQ, 4-Fluorobenzenebutanoic acid, SCHEMBL655425, 4-(4-Fluorophenyl)butyricacid, Benzenebutanoic acid,4-fluoro-, AC1L29X4, Jsp002834, CTK5A9078, KS-00002BKF, 4-(4-fluorophenyl)-butyric acid, DTXSID50207628, 4-(4;-Fluorophenyl)butyric acid, 4-(p-fluorophenyl) butanoic acid, XVQYBBYOYJXQBF-UHFFFAOYSA-N, 4-(4-fluorophenyl)-butanoic acid, HMS1697I05, 3-(4-fluoro benzyl)propionic acid, 4-(4'-Fluorophenyl) butyric acid, beta-(p-fluorobenzyl)propionic acid, ZINC1602066, ANW-44787, SBB010216, AKOS000302631, AF12145, DS-1942, MCULE-6338279408, NSC-409583, RP03271, VZ27788, AJ-28010, AK-35769, AN-46154, BAS 13704771, BC675965, SC-47517, SY039290, TS-00212, AB0041751, DB-005313, ST2405387, TR-030578, 4CH-017685, FT-0602390, ST50321737, Y9557, 4-(4-Fluorophenyl)butanoic acid, AldrichCPR, MFCD03788503 (95%), C-6058, 589F060, I04-5355, J-513517, Z1741966684, 4-(4-Fluorobenzoyl)butyricacid, C10H11FO2, CID68524, AR-1H8477, C10-H11-F-O2, 5-(4-Fluoro-phenyl)-5-oxo-pentanoic acid, A3281, A18951, 149437-76-3, 19883-57-9, 60586-14-3,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.074g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	182.194g/mol
Monoisotopic Mass	182.074g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number