AG00GTP2

Name: 3-(Butyrylamino)-4-methylbenzoic acid
Brand: Angene Chemical
SKU: AG00GTP2

915921-48-1 | 3-(Butyrylamino)-4-methylbenzoic acid

AG00GTP2

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CAS Number	915921-48-1
Catalog Number	AG00GTP2(AGN-PC-0WB53V)
Chemical Name	3-(Butyrylamino)-4-methylbenzoic acid
IUPAC Name	3-(butanoylamino)-4-methylbenzoic acid
InChI	InChI=1S/C12H15NO3/c1-3-4-11(14)13-10-7-9(12(15)16)6-5-8(10)2/h5-7H,3-4H2,1-2H3,(H,13,14)(H,15,16)
InChI Key	QAVYNANBVVTTPC-UHFFFAOYSA-N
MDL Number	MFCD08569892
Molecular Formula	C12H15NO3
Molecular Weight	221.2524
SMILES	C1(C(C)=CC=C(C=1)C(O)=O)NC(CCC)=O
Synonyms	3-(butyrylamino)-4-methylbenzoic acid, 915921-48-1, 3-butanamido-4-methylbenzoic acid, 3-Butyramido-4-methylbenzoic acid, 3-(butanoylamino)-4-methylbenzoic acid, CTK5G9978, DTXSID00589300, CHEMBRDG-BB 9070942, ALBB-003562, 3077AF, BBL013361, MFCD08569892, STK401396, ZINC10779182, AKOS000104604, MCULE-3263773177, AJ-59738, TR-053672, ST45173580, Y-3957, C12H15NO3,

Complexity	265
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.105g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	221.256g/mol
Monoisotopic Mass	221.105g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	66.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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