Name: Name:ethyl 4-cyano-2-(2-cyanoethyl)-2-cyclopropanecarbonylbutanoate
Brand: Angene
SKU: AG01C1RG
Rating: 90 (10 reviews)

ethyl 4-cyano-2-(2-cyanoethyl)-2-cyclopropanecarbonylbutanoate

CAS No.:

1909305-87-8

Catalog Number:

AG01C1RG

Molecular Formula:

C14H18N2O3

Molecular Weight:

262.3043

Catalog Number:

AG01C1RG

Chemical Name:

ethyl 4-cyano-2-(2-cyanoethyl)-2-cyclopropanecarbonylbutanoate

CAS Number:

1909305-87-8

Molecular Formula:

C14H18N2O3

Molecular Weight:

262.3043

MDL Number:

MFCD29047421

IUPAC Name:

ethyl 4-cyano-2-(2-cyanoethyl)-2-(cyclopropanecarbonyl)butanoate

InChI:

InChI=1S/C14H18N2O3/c1-2-19-13(18)14(7-3-9-15,8-4-10-16)12(17)11-5-6-11/h11H,2-8H2,1H3

InChI Key:

HNVLGOJMYPTSHH-UHFFFAOYSA-N

SMILES:

N#CCCC(C(=O)C1CC1)(C(=O)OCC)CCC#N

Complexity:

428

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

262.132g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

262.309g/mol

Monoisotopic Mass:

262.132g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7