200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 1373232-69-9
1373232-69-9 | Benzoic acid, 3-(5-methoxy-3-pyridinyl)-, methyl ester
CAS No: 1373232-69-9 Catalog No: AG00134I MDL No:MFCD22192484
Product Description
Catalog Number:
AG00134I
Chemical Name:
Benzoic acid, 3-(5-methoxy-3-pyridinyl)-, methyl ester
CAS Number:
1373232-69-9
Molecular Formula:
C14H13NO3
Molecular Weight:
243.2579
MDL Number:
MFCD22192484
IUPAC Name:
methyl 3-(5-methoxypyridin-3-yl)benzoate
InChI:
InChI=1S/C14H13NO3/c1-17-13-7-12(8-15-9-13)10-4-3-5-11(6-10)14(16)18-2/h3-9H,1-2H3
InChI Key:
CQXFMTADGDSFSW-UHFFFAOYSA-N
SMILES:
COc1cncc(c1)c1cccc(c1)C(=O)OC
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.262g/mol
Monoisotopic Mass:
243.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.