200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 876665-00-8
876665-00-8 | 2,5-Dimethoxybenzyl 3-methylbutanoate
CAS No: 876665-00-8 Catalog No: AG004KVI MDL No:MFCD23135509
Product Description
Catalog Number:
AG004KVI
Chemical Name:
2,5-Dimethoxybenzyl 3-methylbutanoate
CAS Number:
876665-00-8
Molecular Formula:
C14H20O4
Molecular Weight:
252.3062
MDL Number:
MFCD23135509
IUPAC Name:
(2,5-dimethoxyphenyl)methyl 3-methylbutanoate
InChI:
InChI=1S/C14H20O4/c1-10(2)7-14(15)18-9-11-8-12(16-3)5-6-13(11)17-4/h5-6,8,10H,7,9H2,1-4H3
InChI Key:
RDUFPMXHOICPCV-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1COC(=O)CC(C)C)OC
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.136g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.31g/mol
Monoisotopic Mass:
252.136g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.