200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 89298-75-9
89298-75-9 | Benzenetriol, nitro-
CAS No: 89298-75-9 Catalog No: AG0040WA MDL No:
Product Description
Catalog Number:
AG0040WA
Chemical Name:
Benzenetriol, nitro-
CAS Number:
89298-75-9
Molecular Formula:
C6H5NO5
Molecular Weight:
171.1076
IUPAC Name:
4-nitrobenzene-1,2,3-triol
InChI:
InChI=1S/C6H5NO5/c8-4-2-1-3(7(11)12)5(9)6(4)10/h1-2,8-10H
InChI Key:
FPYOMUFYEZASGS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(c1O)O)O
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.017g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
171.108g/mol
Monoisotopic Mass:
171.017g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.