200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 877874-61-8
877874-61-8 | Benzoic acid, 4-(3-pyridinyloxy)-, methyl ester
CAS No: 877874-61-8 Catalog No: AG00IERJ MDL No:MFCD16040126
Product Description
Catalog Number:
AG00IERJ
Chemical Name:
Benzoic acid, 4-(3-pyridinyloxy)-, methyl ester
CAS Number:
877874-61-8
Molecular Formula:
C13H11NO3
Molecular Weight:
229.2313
MDL Number:
MFCD16040126
IUPAC Name:
methyl 4-pyridin-3-yloxybenzoate
InChI:
InChI=1S/C13H11NO3/c1-16-13(15)10-4-6-11(7-5-10)17-12-3-2-8-14-9-12/h2-9H,1H3
InChI Key:
NCGXAKPNWPIEJG-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1)Oc1cccnc1
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.074g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.235g/mol
Monoisotopic Mass:
229.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
48.4A^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.