AG00IJGK

Name: 3-Cyanobenzyl acetate
Brand: Angene Chemical
SKU: AG00IJGK

95827-10-4 | 3-Cyanobenzyl acetate

AG00IJGK

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CAS Number	95827-10-4
Catalog Number	AG00IJGK(AGN-PC-0MX94S)
Chemical Name	3-Cyanobenzyl acetate
IUPAC Name	(3-cyanophenyl)methyl acetate
InChI	InChI=1S/C10H9NO2/c1-8(12)13-7-10-4-2-3-9(5-10)6-11/h2-5H,7H2,1H3
InChI Key	HASPIPUGHLZBHX-UHFFFAOYSA-N
MDL Number	MFCD20265240
Molecular Formula	C10H9NO2
Molecular Weight	175.1840
SMILES	C1(C#N)C=CC=C(COC(=O)C)C=1
Synonyms	3-(Acetoxymethyl)benzonitrile, 3-Cyanobenzyl acetate, 95827-10-4, (3-cyanophenyl)methyl Acetate, m-cyanobenzyl acetate, SCHEMBL2659356, HASPIPUGHLZBHX-UHFFFAOYSA-N, MFCD20265240, ZINC34075869, 3-(Acetoxymethyl)benzonitrile, AldrichCPR, CID10012422,

Complexity	228
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	175.063g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	175.187g/mol
Monoisotopic Mass	175.063g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	50.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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