200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 74543-18-3
74543-18-3 | Benzenesulfonic acid,4-methyl-3,5-dinitro-, sodium salt (1:1)
CAS No: 74543-18-3 Catalog No: AG008PS9 MDL No:
Product Description
Catalog Number:
AG008PS9
Chemical Name:
Benzenesulfonic acid,4-methyl-3,5-dinitro-, sodium salt (1:1)
CAS Number:
74543-18-3
Molecular Formula:
C7H6N2O7S
Molecular Weight:
262.1967
IUPAC Name:
4-methyl-2,6-dinitrobenzenesulfonic acid
InChI:
InChI=1S/C7H6N2O7S/c1-4-2-5(8(10)11)7(17(14,15)16)6(3-4)9(12)13/h2-3H,1H3,(H,14,15,16)
InChI Key:
AZAOMIDKMZHOPH-UHFFFAOYSA-N
SMILES:
Cc1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])S(=O)(=O)O
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.99g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.192g/mol
Monoisotopic Mass:
261.99g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
154A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.