200,000+ products from a single source!
sales@angenechem.com
100059-71-0 | 2-Furancarboxylic acid, 4-[(acetyloxy)methyl]-5-ethyl-, methyl ester
CAS No: 100059-71-0 Catalog No: AG0000SH MDL No:
Product Description
Catalog Number:
AG0000SH
Chemical Name:
2-Furancarboxylic acid, 4-[(acetyloxy)methyl]-5-ethyl-, methyl ester
CAS Number:
100059-71-0
Molecular Formula:
C11H14O5
Molecular Weight:
226.2259
IUPAC Name:
methyl 4-(acetyloxymethyl)-5-ethylfuran-2-carboxylate
InChI:
InChI=1S/C11H14O5/c1-4-9-8(6-15-7(2)12)5-10(16-9)11(13)14-3/h5H,4,6H2,1-3H3
InChI Key:
NCBUAINZUNVQMO-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(c(o1)CC)COC(=O)C
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.084g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.228g/mol
Monoisotopic Mass:
226.084g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
65.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.