AG003SBM

7377-08-4 | N-(4-Aminobenzoyl)-beta-alanine

AG003SBM

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CAS Number	7377-08-4
Catalog Number	AG003SBM(AGN-PC-0U3U9A)
Chemical Name	N-(4-Aminobenzoyl)-beta-alanine
EC Number	616-017-7
IUPAC Name	3-[(4-aminobenzoyl)amino]propanoic acid
InChI	InChI=1S/C10H12N2O3/c11-8-3-1-7(2-4-8)10(15)12-6-5-9(13)14/h1-4H,5-6,11H2,(H,12,15)(H,13,14)
InChI Key	VHAXWROFYVPXMZ-UHFFFAOYSA-N
MDL Number	MFCD00009805
Molecular Formula	C10H12N2O3
Molecular Weight	208.2139
SMILES	O=C(O)CCNC(C1=CC=C(N)C=C1)=O
UNII	AB85LJQ945
Synonyms	4-aminobenzoyl-alanine, 4-aminobenzoyl-beta-alanine, N-(4-Aminobenzoyl)-Beta-Alanine, 7377-08-4, 3-(4-aminobenzamido)propanoic acid, 3-(4-amino-benzoylamino)-propionic acid, 4-aminobenzoyl-beta-alanine, UNII-AB85LJQ945, AB85LJQ945, 3-(4-Aminobenzamido)propionic Acid, MFCD00009805, 3-[(4-aminobenzoyl)amino]propanoic Acid, N-[(4-aminophenyl)carbonyl]-beta-alanine, 3-((4-Aminobenzoyl)amino)propanoic acid, 3-[(4-aminophenyl)carbonylamino]propanoic acid, n-(4-aminobenzoyl)-|A-alanine, AC1LEXJN, PubChem20692, 1-Benzoylpyrene, 98%, AC1Q5EAC, AC1Q51TL, SCHEMBL130343, n-(4-aminobenzoyl)-b-alanine, 4-Aminobenzoyl-(beta)-alanine, ACMC-2097l0, p-Amino-N-benzoyl-beta-alanine, CTK7F7207, DTXSID30224136, N-(4-Aminobenzoyl)-|?-alanine, N-4-(Aminobenzoyl)-beta-Alanine, VHAXWROFYVPXMZ-UHFFFAOYSA-N, ZINC120074, BCP18194, beta-Alanine, N-(p-aminobenzoyl)-, beta-Alanine, N-(4-aminobenzoyl)-, ANW-14098, BBL004484, CA-174, SBB000472, STK898998, 3-(4-Aminobenzoylamino)propionic acid, AKOS000120590, BS-4182, MCULE-2559626649, TRA0022235, VZ32928, KS-000012D4, AJ-11659, K254, SC-17454, Ethyl 5-methyl-1H-indazole-6-carboxylate, 3-[(4-aminophenyl)formamido]propanoic acid, DB-055799, ST2413549, TR-023912, BB 0242973, FT-0636462, H2922, ST50308391, 3-(4-AMINOBENZOYLAMINO)-PROPIONIC ACID, I01-2771, N- -beta-alanine, C10H12N2O3, AR-1J8917, CID719629, A2347, 7435-02-1,

Complexity	235
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	208.085g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	208.217g/mol
Monoisotopic Mass	208.085g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	92.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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