200,000+ products from a single source!

sales@angenechem.com

Home > Carboxes > 17837-68-2

17837-68-2

17837-68-2 | 4-Cinnolinol, 6-chloro-5-nitro-

CAS No: 17837-68-2 Catalog No: AG0025YX MDL No:

Product Description

Catalog Number:
AG0025YX
Chemical Name:
4-Cinnolinol, 6-chloro-5-nitro-
CAS Number:
17837-68-2
Molecular Formula:
C8H4ClN3O3
Molecular Weight:
225.5887
IUPAC Name:
6-chloro-5-nitro-1H-cinnolin-4-one
InChI:
InChI=1S/C8H4ClN3O3/c9-4-1-2-5-7(8(4)12(14)15)6(13)3-10-11-5/h1-3H,(H,11,13)
InChI Key:
PUHDGVZFMDHNQZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(Cl)ccc2c1c(O)cnn2

Properties

Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.994g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.588g/mol
Monoisotopic Mass:
224.994g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Related Products

© 2019 Angene International Limited. All rights Reserved.