200,000+ products from a single source!
sales@angenechem.com
199285-56-8 | 3-Pyridinecarboxylic acid, 5-(cyano-1-naphthalenylmethyl)-
CAS No: 199285-56-8 Catalog No: AG002C0X MDL No:
Product Description
Catalog Number:
AG002C0X
Chemical Name:
3-Pyridinecarboxylic acid, 5-(cyano-1-naphthalenylmethyl)-
CAS Number:
199285-56-8
Molecular Formula:
C18H12N2O2
Molecular Weight:
288.3001
IUPAC Name:
5-[cyano(naphthalen-1-yl)methyl]pyridine-3-carboxylic acid
InChI:
InChI=1S/C18H12N2O2/c19-9-17(13-8-14(18(21)22)11-20-10-13)16-7-3-5-12-4-1-2-6-15(12)16/h1-8,10-11,17H,(H,21,22)
InChI Key:
NKPKJXBXHKZNBQ-UHFFFAOYSA-N
SMILES:
N#CC(c1cccc2c1cccc2)c1cncc(c1)C(=O)O
Properties
Complexity:
455
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.09g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
288.306g/mol
Monoisotopic Mass:
288.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
74A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.