200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1020724-40-6
1020724-40-6 | 1H-Pyrazole-4-carboxylic acid, 3-(2-methoxyphenyl)-1-methyl-, methyl ester
CAS No: 1020724-40-6 Catalog No: AG0006KP MDL No:
Product Description
Catalog Number:
AG0006KP
Chemical Name:
1H-Pyrazole-4-carboxylic acid, 3-(2-methoxyphenyl)-1-methyl-, methyl ester
CAS Number:
1020724-40-6
Molecular Formula:
C13H14N2O3
Molecular Weight:
246.2619
IUPAC Name:
methyl 3-(2-methoxyphenyl)-1-methylpyrazole-4-carboxylate
InChI:
InChI=1S/C13H14N2O3/c1-15-8-10(13(16)18-3)12(14-15)9-6-4-5-7-11(9)17-2/h4-8H,1-3H3
InChI Key:
HSJZFDSJSOFMBP-UHFFFAOYSA-N
SMILES:
COC(=O)c1cn(nc1c1ccccc1OC)C
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.1g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.266g/mol
Monoisotopic Mass:
246.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
53.4A^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.