200,000+ products from a single source!

sales@angenechem.com

Home > Other Building Blocks > 14920-81-1

14920-81-1

14920-81-1 | Benzoic acid, 2,6-dimethyl-, methyl ester

CAS No: 14920-81-1 Catalog No: AG001LGV MDL No:MFCD06203721

Product Description

Catalog Number:
AG001LGV
Chemical Name:
Benzoic acid, 2,6-dimethyl-, methyl ester
CAS Number:
14920-81-1
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
MDL Number:
MFCD06203721
IUPAC Name:
methyl 2,6-dimethylbenzoate
InChI:
InChI=1S/C10H12O2/c1-7-5-4-6-8(2)9(7)10(11)12-3/h4-6H,1-3H3
InChI Key:
XJMULMWDHLJUKP-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(C)cccc1C

Properties

Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.084g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.204g/mol
Monoisotopic Mass:
164.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

© 2019 Angene International Limited. All rights Reserved.