Benzoic acid, 2-methoxy-5-methyl-, methyl ester


Chemical Name: Benzoic acid, 2-methoxy-5-methyl-, methyl ester
CAS Number: 63113-79-1
Product Number: AG003ROD(AGN-PC-0N169N)
Synonyms:
MDL No:
Molecular Formula: C10H12O3
Molecular Weight: 180.20048

Identification/Properties


Properties
BP:
124-131 °C22 mm Hg(lit.)
Form:
Liquid
Refractive Index:
n20/D 1.5310(lit.)
Computed Properties
Molecular Weight:
180.203g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
180.079g/mol
Monoisotopic Mass:
180.079g/mol
Topological Polar Surface Area:
35.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
179
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback