200,000+ products from a single source!
sales@angenechem.com
7216-42-4 | 4-Pyridinecarboxaldehyde N-oxide
CAS No: 7216-42-4 Catalog No: AG003M0H MDL No:
Product Description
Catalog Number:
AG003M0H
Chemical Name:
4-Pyridinecarboxaldehyde N-oxide
CAS Number:
7216-42-4
Molecular Formula:
C6H7NO2
Molecular Weight:
125.1253
IUPAC Name:
1-oxidopyridin-1-ium-4-carbaldehyde
InChI:
InChI=1S/C6H5NO2/c8-5-6-1-3-7(9)4-2-6/h1-5H
InChI Key:
ZAZQKVZJRMHPQP-UHFFFAOYSA-N
SMILES:
O=Cc1ccncc1.O
EC Number:
230-602-0
Properties
Complexity:
97.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.032g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
123.111g/mol
Monoisotopic Mass:
123.032g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.