Name: Name:Benzenepropanoic acid, β-ethyl-3-hydroxy-, methyl ester
Brand: Angene
SKU: AG000AUZ
Rating: 90 (10 reviews)

Benzenepropanoic acid, β-ethyl-3-hydroxy-, methyl ester

CAS No.:

1142234-16-9

Catalog Number:

AG000AUZ

Molecular Formula:

C12H16O3

Molecular Weight:

208.2536

Catalog Number:

AG000AUZ

Chemical Name:

Benzenepropanoic acid, β-ethyl-3-hydroxy-, methyl ester

CAS Number:

1142234-16-9

Molecular Formula:

C12H16O3

Molecular Weight:

208.2536

MDL Number:

MFCD27959541

IUPAC Name:

methyl 3-(3-hydroxyphenyl)pentanoate

InChI:

InChI=1S/C12H16O3/c1-3-9(8-12(14)15-2)10-5-4-6-11(13)7-10/h4-7,9,13H,3,8H2,1-2H3

InChI Key:

APYKJHDCYFIQJM-UHFFFAOYSA-N

SMILES:

CCC(c1cccc(c1)O)CC(=O)OC

Complexity:

203

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

208.11g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

208.257g/mol

Monoisotopic Mass:

208.11g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5