200,000+ products from a single source!
sales@angenechem.com
75056-37-0 | Benzenesulfonic acid,4-[2-(2-amino-6,9-dihydro-6-oxo-1H-purin-8-yl)diazenyl]-
CAS No: 75056-37-0 Catalog No: AG005ENE MDL No:
Product Description
Catalog Number:
AG005ENE
Chemical Name:
Benzenesulfonic acid,4-[2-(2-amino-6,9-dihydro-6-oxo-1H-purin-8-yl)diazenyl]-
CAS Number:
75056-37-0
Molecular Formula:
C11H9N7O4S
Molecular Weight:
335.2987
IUPAC Name:
4-[(2-amino-6-oxo-1,7-dihydropurin-8-yl)diazenyl]benzenesulfonic acid
InChI:
InChI=1S/C11H9N7O4S/c12-10-14-8-7(9(19)16-10)13-11(15-8)18-17-5-1-3-6(4-2-5)23(20,21)22/h1-4H,(H,20,21,22)(H4,12,13,14,15,16,19)
InChI Key:
WLZVIPJWGHVKJK-UHFFFAOYSA-N
SMILES:
NC1=NC(=O)C2C(=NC(=N2)N=Nc2ccc(cc2)S(=O)(=O)O)N1
NSC Number:
24124
Properties
Complexity:
635
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.044g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
335.298g/mol
Monoisotopic Mass:
335.044g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
184A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.