200,000+ products from a single source!
sales@angenechem.com
116045-92-2 | 2-Pyridinecarboxylic acid, 1-methylethenyl ester
CAS No: 116045-92-2 Catalog No: AG000BGI MDL No:
Product Description
Catalog Number:
AG000BGI
Chemical Name:
2-Pyridinecarboxylic acid, 1-methylethenyl ester
CAS Number:
116045-92-2
Molecular Formula:
C9H9NO2
Molecular Weight:
163.1733
IUPAC Name:
prop-1-en-2-yl pyridine-2-carboxylate
InChI:
InChI=1S/C9H9NO2/c1-7(2)12-9(11)8-5-3-4-6-10-8/h3-6H,1H2,2H3
InChI Key:
IJRXZLCBKMBAGZ-UHFFFAOYSA-N
SMILES:
CC(=C)OC(=O)c1ccccn1
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.063g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.176g/mol
Monoisotopic Mass:
163.063g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.