AG00CKHG

Name: 3-Cyano-2-methylbenzoic acid
Brand: Angene Chemical
SKU: AG00CKHG

3843-99-0 | 3-Cyano-2-methylbenzoic acid

AG00CKHG

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COA

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WARNING This product is not for human or veterinary use.

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CAS Number	3843-99-0
Catalog Number	AG00CKHG
Chemical Name	3-Cyano-2-methylbenzoic acid
IUPAC Name	3-cyano-2-methylbenzoic acid
InChI	InChI=1S/C9H7NO2/c1-6-7(5-10)3-2-4-8(6)9(11)12/h2-4H,1H3,(H,11,12)
InChI Key	QPEFUCOMFYTEKE-UHFFFAOYSA-N
MDL Number	MFCD18394327
Molecular Formula	C9H7NO2
Molecular Weight	161.1574
SMILES	O=C(O)C1=CC=CC(C#N)=C1C
Synonyms	3-cyano-2-methylbenzoic acid, 3843-99-0, 2-methyl-3-cyano-benzoic acid, 3-cyano-2-methyl-benzoic acid, SCHEMBL1352722, QPEFUCOMFYTEKE-UHFFFAOYSA-N, ZINC96868746, AKOS017514857, Z2004547966,

Complexity	228
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	161.048g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	161.16g/mol
Monoisotopic Mass	161.048g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	61.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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