AG00C904

Name: 4-Chloro-2-(isobutyrylamino)benzoic acid
Brand: Angene Chemical
SKU: AG00C904

405904-57-6 | 4-Chloro-2-(isobutyrylamino)benzoic acid

AG00C904

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CAS Number	405904-57-6
Catalog Number	AG00C904(AGN-PC-0WB4GT)
Chemical Name	4-Chloro-2-(isobutyrylamino)benzoic acid
IUPAC Name	4-chloro-2-(2-methylpropanoylamino)benzoic acid
InChI	InChI=1S/C11H12ClNO3/c1-6(2)10(14)13-9-5-7(12)3-4-8(9)11(15)16/h3-6H,1-2H3,(H,13,14)(H,15,16)
InChI Key	UQZGIAQVBMWVFR-UHFFFAOYSA-N
MDL Number	MFCD02032212
Molecular Formula	C11H12ClNO3
Molecular Weight	241.6709
SMILES	C1(C=CC(=CC=1NC(C(C)C)=O)Cl)C(O)=O
Synonyms	405904-57-6, 4-CHLORO-2-(ISOBUTYRYLAMINO)BENZOIC ACID, 4-Chloro-2-isobutyramidobenzoic acid, 4-chloro-2-[(2-methylpropanoyl)amino]benzoic acid, CTK4I3377, DTXSID20588330, ZX-CM016457, BBL005436, MFCD02032212, STK520513, ZINC13185605, AKOS000133300, MCULE-6372868432, AJ-63452, 4-Chloro-2-(2-methylpropanamido)benzoic acid, W-8968, 4-Chloro-2- benzoicacid,

Complexity	280
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	241.051g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	241.671g/mol
Monoisotopic Mass	241.051g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

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