AG01FPK0

Name: Benzoic acid, 3-cyano-2-methyl-, methyl ester
Brand: Angene Chemical
SKU: AG01FPK0

93340-09-1 | Benzoic acid, 3-cyano-2-methyl-, methyl ester

AG01FPK0

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CAS Number	93340-09-1
Catalog Number	AG01FPK0(AGN-PC-00L9HY)
Chemical Name	Benzoic acid, 3-cyano-2-methyl-, methyl ester
IUPAC Name	methyl 3-cyano-2-methylbenzoate
InChI	InChI=1S/C10H9NO2/c1-7-8(6-11)4-3-5-9(7)10(12)13-2/h3-5H,1-2H3
InChI Key	FHBWZNLFBLOUKX-UHFFFAOYSA-N
MDL Number	MFCD14584407
Molecular Formula	C10H9NO2
Molecular Weight	175.1840
SMILES	O=C(OC)C1=CC=CC(C#N)=C1C
Synonyms	METHYL 3-CYANO-2-METHYLBENZOATE, 93340-09-1, 3-cyano-2-methyl-benzoic acid methyl ester, SCHEMBL646271, methyl3-cyano-2-methylbenzoate, DTXSID30524446, FHBWZNLFBLOUKX-UHFFFAOYSA-N, ZINC39414077, DB-017996, FT-0705065, 3-cyano-2-methylBenzoic acid methyl ester,

Complexity	241
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	175.063329g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	175.18g/mol
Monoisotopic Mass	175.063329g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	50.1Å²
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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