200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 6963-03-7
6963-03-7 | 6-NITRO-4H-1,3-BENZODIOXINE
CAS No: 6963-03-7 Catalog No: AG00FE3C MDL No:MFCD00086349
Product Description
Catalog Number:
AG00FE3C
Chemical Name:
6-NITRO-4H-1,3-BENZODIOXINE
CAS Number:
6963-03-7
Molecular Formula:
C8H7NO4
Molecular Weight:
181.1455
MDL Number:
MFCD00086349
IUPAC Name:
6-nitro-4H-1,3-benzodioxine
InChI:
InChI=1S/C8H7NO4/c10-9(11)7-1-2-8-6(3-7)4-12-5-13-8/h1-3H,4-5H2
InChI Key:
RCVQOAMNZPWAIM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)COCO2
NSC Number:
53708
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.038g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.147g/mol
Monoisotopic Mass:
181.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| The anti-arthritic and anti-oxidative effect of NBD (6-nitro-1,3-benzodioxane) in adjuvant-induced arthritis (AIA) in rats. | Inflammation research : official journal of the European Histamine Research Society ... [et al.] 20120801 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.