AG0000FV

SDS

COA

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CAS Number	1000341-18-3
Catalog Number	AG0000FV(AGN-PC-0WQV5L)
Chemical Name	Benzoic acid, 3-amino-5-cyano-
IUPAC Name	3-amino-5-cyanobenzoic acid
InChI	InChI=1S/C8H6N2O2/c9-4-5-1-6(8(11)12)3-7(10)2-5/h1-3H,10H2,(H,11,12)
InChI Key	CCWVOHSNQZFXQU-UHFFFAOYSA-N
MDL Number	MFCD11049370
Molecular Formula	C8H6N2O2
Molecular Weight	162.1454
SMILES	O=C(O)C1=CC(C#N)=CC(N)=C1
Synonyms	3-AMINO-5-CYANOBENZOIC ACID, 1000341-18-3, 3-Amino-5-cyanorobenzoic acid, Benzoic acid, 3-amino-5-cyano-, SCHEMBL13674520, ZINC14985993, AKOS006330681, AB50174, CS-13384, CS-0030477, W-1069, 3-amino-5-cyano-benzoic acid methyl ester, 199536-01-1,

Complexity	231
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	162.043g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	162.148g/mol
Monoisotopic Mass	162.043g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	87.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

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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