AG009BHB

14161-84-3 | 2-(3-CHLOROPHENYL)PROPIONIC ACID

AG009BHB

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CAS Number	14161-84-3
Catalog Number	AG009BHB(AGN-PC-0PR3M5)
Chemical Name	2-(3-CHLOROPHENYL)PROPIONIC ACID
IUPAC Name	2-(3-chlorophenyl)propanoic acid
InChI	InChI=1S/C9H9ClO2/c1-6(9(11)12)7-3-2-4-8(10)5-7/h2-6H,1H3,(H,11,12)
InChI Key	YRUBJDXEYFCYCX-UHFFFAOYSA-N
MDL Number	MFCD03412454
Molecular Formula	C9H9ClO2
Molecular Weight	184.6196
SMILES	CC(C(O)=O)C1=CC=CC(Cl)=C1
Synonyms	2-(3-Chlorophenyl)propanoic acid, 14161-84-3, 2-(3-CHLOROPHENYL)PROPIONIC ACID, Benzeneacetic acid,3-chloro-a-methyl-, 2-(3-CHLORO-PHENYL)-PROPIONIC ACID, SCHEMBL1917129, CTK4C2724, DTXSID90518482, YRUBJDXEYFCYCX-UHFFFAOYSA-N, 2-(3-chlorophenyl) propanoic acid, KS-00000N5G, 6891AA, ANW-63963, MFCD03412454, AKOS008151863, AB14392, EBD2221155, MCULE-6523517926, AK-59290, DS-16289, DB-063388, TC-152708, 4CH-021657, BB 0260686, FT-0720376, ST24039307, 2-(3-chlorophenyl)propionic acid, AldrichCPR, EN300-90386, Z-4763, I14-40377, C9H9ClO2, 1643-28-3,

Complexity	170
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.029g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	184.619g/mol
Monoisotopic Mass	184.029g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H332-H335
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 2811

Certificate of Analysis

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