200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 1255574-49-2
1255574-49-2 | 3-Pyridinecarbonitrile, 5-(4-formylphenyl)-
CAS No: 1255574-49-2 Catalog No: AG000NUD MDL No:MFCD17214277
Product Description
Catalog Number:
AG000NUD
Chemical Name:
3-Pyridinecarbonitrile, 5-(4-formylphenyl)-
CAS Number:
1255574-49-2
Molecular Formula:
C13H8N2O
Molecular Weight:
208.2154
MDL Number:
MFCD17214277
IUPAC Name:
5-(4-formylphenyl)pyridine-3-carbonitrile
InChI:
InChI=1S/C13H8N2O/c14-6-11-5-13(8-15-7-11)12-3-1-10(9-16)2-4-12/h1-5,7-9H
InChI Key:
CNRZLMIBTWWUGG-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1cncc(c1)C#N
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.064g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.22g/mol
Monoisotopic Mass:
208.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.8A^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.