Name: Name:2-Propenoic acid, 3-(3-cyanophenyl)-2-methyl-, ethyl ester, (2Z)-
Brand: Angene
SKU: AG002WPB
Rating: 90 (10 reviews)

2-Propenoic acid, 3-(3-cyanophenyl)-2-methyl-, ethyl ester, (2Z)-

CAS No.:

288309-15-9

Catalog Number:

AG002WPB

Molecular Formula:

C13H13NO2

Molecular Weight:

215.2478

Catalog Number:

AG002WPB

Chemical Name:

2-Propenoic acid, 3-(3-cyanophenyl)-2-methyl-, ethyl ester, (2Z)-

CAS Number:

288309-15-9

Molecular Formula:

C13H13NO2

Molecular Weight:

215.2478

MDL Number:

MFCD09953796

IUPAC Name:

ethyl (Z)-3-(3-cyanophenyl)-2-methylprop-2-enoate

InChI:

InChI=1S/C13H13NO2/c1-3-16-13(15)10(2)7-11-5-4-6-12(8-11)9-14/h4-8H,3H2,1-2H3/b10-7-

InChI Key:

QJDAMUGGTNWDHJ-YFHOEESVSA-N

SMILES:

CCOC(=O)/C(=C\c1cccc(c1)C#N)/C

Complexity:

324

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

215.095g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

215.252g/mol

Monoisotopic Mass:

215.095g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

50.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7