AG0097MQ

Name: Cyanomethyl acetate
Brand: Angene Chemical
SKU: AG0097MQ

1001-55-4 | Cyanomethyl acetate

AG0097MQ

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CAS Number	1001-55-4
Catalog Number	AG0097MQ(AGN-PC-0JKBEQ)
Chemical Name	Cyanomethyl acetate
IUPAC Name	cyanomethyl acetate
InChI	InChI=1S/C4H5NO2/c1-4(6)7-3-2-5/h3H2,1H3
InChI Key	AJEHNBIPLQJTNU-UHFFFAOYSA-N
MDL Number	MFCD00242714
Molecular Formula	C4H5NO2
Molecular Weight	99.0880
NSC Number	71942
SMILES	CC(OCC#N)=O
UNII	VM1DZ0X2D6
Synonyms	Cyanomethyl acetate, Acetoxyacetonitrile, UNII-VM1DZ0X2D6, HSDB 2124, NSC 71942, Kyanmethylester kyseliny octove [Czech], BRN 1745113, VM1DZ0X2D6, Kyanmethylester kyseliny octove, acetonitrile acetate, AC1Q1LBK, AC1L22LN, 1001-55-4, WLN: NC1OV1, 3-03-00-00401 (Beilstein Handbook Reference), CTK6A2411, DTXSID00142939, AJEHNBIPLQJTNU-UHFFFAOYSA-N, Acetonitrile, (acetyloxy)- (9CI), NSC71942, ZINC4804419, NSC-71942, AKOS027473379, Glycolonitrile, acetate, Glycolonitrile, acetate (ester) (8CI), LS-72927, EN300-40098, cyanomethylacetate, Acetonitrilo, 2-(acetiloxi)-, C4-H5-N-O2, CID13843, Acetic acid cyanomethyl ester, (ACETYLOXY)ACETONITRILE, Glycolonitrile, acetate (ester), Acetyloxyacetonitrile, Acetonitrile, (acetyloxy)-, 2-Acetoxyacetonitrile,

Complexity	110
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	99.032g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	99.089g/mol
Monoisotopic Mass	99.032g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	50.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

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