Name: Name:Benzenebutanoic acid, 4-methoxy-γ-oxo-, ethyl ester
Brand: Angene
SKU: AG001N5H
Rating: 90 (10 reviews)

Benzenebutanoic acid, 4-methoxy-γ-oxo-, ethyl ester

CAS No.:

15118-67-9

Catalog Number:

AG001N5H

Molecular Formula:

C13H16O4

Molecular Weight:

236.2637

Catalog Number:

AG001N5H

Chemical Name:

Benzenebutanoic acid, 4-methoxy-γ-oxo-, ethyl ester

CAS Number:

15118-67-9

Molecular Formula:

C13H16O4

Molecular Weight:

236.2637

MDL Number:

MFCD00051784

IUPAC Name:

ethyl 4-(4-methoxyphenyl)-4-oxobutanoate

InChI:

InChI=1S/C13H16O4/c1-3-17-13(15)9-8-12(14)10-4-6-11(16-2)7-5-10/h4-7H,3,8-9H2,1-2H3

InChI Key:

FYUAOZFEVHSJTO-UHFFFAOYSA-N

SMILES:

CCOC(=O)CCC(=O)c1ccc(cc1)OC

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

236.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

236.267g/mol

Monoisotopic Mass:

236.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1