200,000+ products from a single source!
sales@angenechem.com
57672-33-0 | 7-Nitro-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid
CAS No: 57672-33-0 Catalog No: AG003NGO MDL No:MFCD01116988
Product Description
Catalog Number:
AG003NGO
Chemical Name:
7-Nitro-2,3-dihydro-1,4-benzodioxine-6-carboxylic acid
CAS Number:
57672-33-0
Molecular Formula:
C9H7NO6
Molecular Weight:
225.1550
MDL Number:
MFCD01116988
IUPAC Name:
6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid
InChI:
InChI=1S/C9H7NO6/c11-9(12)5-3-7-8(16-2-1-15-7)4-6(5)10(13)14/h3-4H,1-2H2,(H,11,12)
InChI Key:
QBFGQHROZQJASA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2OCCOc2cc1C(=O)O
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.027g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.156g/mol
Monoisotopic Mass:
225.027g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.