200,000+ products from a single source!
sales@angenechem.com
82119-78-6 | 2H-1-Benzopyran-3-carboxylicacid, 8-nitro-2-oxo-
CAS No: 82119-78-6 Catalog No: AG005AAD MDL No:MFCD03949037
Product Description
Catalog Number:
AG005AAD
Chemical Name:
2H-1-Benzopyran-3-carboxylicacid, 8-nitro-2-oxo-
CAS Number:
82119-78-6
Molecular Formula:
C10H5NO6
Molecular Weight:
235.1498
MDL Number:
MFCD03949037
IUPAC Name:
8-nitro-2-oxochromene-3-carboxylic acid
InChI:
InChI=1S/C10H5NO6/c12-9(13)6-4-5-2-1-3-7(11(15)16)8(5)17-10(6)14/h1-4H,(H,12,13)
InChI Key:
GZRJTAOIBQPQKZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc2c1oc(=O)c(c2)C(=O)O
Properties
Complexity:
410
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.012g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.151g/mol
Monoisotopic Mass:
235.012g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.