AG00577K

Name: 3-(Butyrylamino)benzoic acid
Brand: Angene Chemical
SKU: AG00577K

76209-00-2 | 3-(Butyrylamino)benzoic acid

AG00577K

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CAS Number	76209-00-2
Catalog Number	AG00577K(AGN-PC-0JV115)
Chemical Name	3-(Butyrylamino)benzoic acid
IUPAC Name	3-(butanoylamino)benzoic acid
InChI	InChI=1S/C11H13NO3/c1-2-4-10(13)12-9-6-3-5-8(7-9)11(14)15/h3,5-7H,2,4H2,1H3,(H,12,13)(H,14,15)
InChI Key	ASXLJZIPYBUVFW-UHFFFAOYSA-N
MDL Number	MFCD00448227
Molecular Formula	C11H13NO3
Molecular Weight	207.2258
SMILES	C(O)(=O)C1C=CC=C(C=1)NC(CCC)=O
Synonyms	3-(butyrylamino)benzoic acid, 76209-00-2, 3-Butyramidobenzoic acid, 3-(butanoylamino)benzoic acid, 3-butanamidobenzoic acid, AC1LEVQV, AC1Q5M5S, Oprea1_541878, SCHEMBL11221078, CTK5E2587, ZINC64981, DTXSID10351191, ALBB-010048, 9366AE, BBL003533, MFCD00448227, STK501280, AKOS000104591, Benzoic acid,3-[(1-oxobutyl)amino]-, MCULE-2868397895, Benzoic acid, 3-[(1-oxobutyl)amino]-, AJ-10140, AB0155035, TX-011842, FT-0679642, ST45136804, W-6896, I01-13404, C11H13NO3, AR-1F2344, CID693165, 7698-98-8,

Complexity	240
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	207.09g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	207.229g/mol
Monoisotopic Mass	207.09g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited