AG00H8P8

64198-92-1 | 2-(3-Benzamidophenyl)acetic acid

AG00H8P8

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CAS Number	64198-92-1
Catalog Number	AG00H8P8(AGN-PC-00KOH9)
Chemical Name	2-(3-Benzamidophenyl)acetic acid
IUPAC Name	2-(3-benzamidophenyl)acetic acid
InChI	InChI=1S/C15H13NO3/c17-14(18)10-11-5-4-8-13(9-11)16-15(19)12-6-2-1-3-7-12/h1-9H,10H2,(H,16,19)(H,17,18)
InChI Key	NHHLTORYOVGHJT-UHFFFAOYSA-N
MDL Number	MFCD10026675
Molecular Formula	C15H13NO3
Molecular Weight	255.2686
SMILES	O=C(O)CC1=CC=CC(NC(C2=CC=CC=C2)=O)=C1
Synonyms	2-(3-Benzamidophenyl)acetic acid, 64198-92-1, (3-Benzamidophenyl)acetic acid, CTK2A6888, DTXSID60516738, MFCD10026675, ZINC20226912, AKOS014681740, Benzeneacetic acid, 3-(benzoylamino)-, DS-9949, AK198881,

Complexity	323
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	255.09g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	255.273g/mol
Monoisotopic Mass	255.09g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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

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