200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 133362-99-9
133362-99-9 | Benzoic acid, 2-(4-pyridinyl)-
CAS No: 133362-99-9 Catalog No: AG0014QH MDL No:MFCD08056297
Product Description
Catalog Number:
AG0014QH
Chemical Name:
Benzoic acid, 2-(4-pyridinyl)-
CAS Number:
133362-99-9
Molecular Formula:
C12H9NO2
Molecular Weight:
199.2054
MDL Number:
MFCD08056297
IUPAC Name:
2-pyridin-4-ylbenzoic acid
InChI:
InChI=1S/C12H9NO2/c14-12(15)11-4-2-1-3-10(11)9-5-7-13-8-6-9/h1-8H,(H,14,15)
InChI Key:
GZUBBCPCJHBRDY-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccccc1c1ccncc1
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.063g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.209g/mol
Monoisotopic Mass:
199.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.