AG01A7JB

Name: Methyl 2-cyano-2-ethylbutanoate
Brand: Angene Chemical
SKU: AG01A7JB

53692-88-9 | Methyl 2-cyano-2-ethylbutanoate

AG01A7JB

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CAS Number	53692-88-9
Catalog Number	AG01A7JB(AGN-PC-0WO2G9)
Chemical Name	Methyl 2-cyano-2-ethylbutanoate
IUPAC Name	methyl 2-cyano-2-ethylbutanoate
InChI	InChI=1S/C8H13NO2/c1-4-8(5-2,6-9)7(10)11-3/h4-5H2,1-3H3
InChI Key	TUBVFZQQDWUXFI-UHFFFAOYSA-N
MDL Number	MFCD14693745
Molecular Formula	C8H13NO2
Molecular Weight	155.1943
SMILES	CCC(C(OC)=O)(C#N)CC
Synonyms	methyl 2-cyano-2-ethylbutanoate, 53692-88-9, SCHEMBL3542102, methyl2-cyano-2-ethyl-butanoate, TUBVFZQQDWUXFI-UHFFFAOYSA-N, ZINC49715740, AKOS010824045, MCULE-5299402205, NE15836, 2-Ethyl-2-cyanobutanoic acid methyl ester, Z1492800324,

Complexity	186
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	155.095g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	155.197g/mol
Monoisotopic Mass	155.095g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	50.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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