200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 13678-62-1
13678-62-1 | 2-Butenoic acid, 3-methyl-, 2-furanylmethyl ester
CAS No: 13678-62-1 Catalog No: AG0012CW MDL No:
Product Description
Catalog Number:
AG0012CW
Chemical Name:
2-Butenoic acid, 3-methyl-, 2-furanylmethyl ester
CAS Number:
13678-62-1
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
IUPAC Name:
furan-2-ylmethyl 3-methylbut-2-enoate
InChI:
InChI=1S/C10H12O3/c1-8(2)6-10(11)13-7-9-4-3-5-12-9/h3-6H,7H2,1-2H3
InChI Key:
WQRKWVMLUMILJU-UHFFFAOYSA-N
SMILES:
CC(=CC(=O)OCc1ccco1)C
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.203g/mol
Monoisotopic Mass:
180.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.