200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 26196-08-7
26196-08-7 | 2,7-Naphthalenedisulfonic acid, 4,5-dihydroxy-3,6-bis[2-(2-hydroxy-5-nitro-3-sulfophenyl)diazenyl]-
CAS No: 26196-08-7 Catalog No: AG002S87 MDL No:
Product Description
Catalog Number:
AG002S87
Chemical Name:
2,7-Naphthalenedisulfonic acid, 4,5-dihydroxy-3,6-bis[2-(2-hydroxy-5-nitro-3-sulfophenyl)diazenyl]-
CAS Number:
26196-08-7
Molecular Formula:
C22H14N6O20S4
Molecular Weight:
810.6348
IUPAC Name:
4,5-dihydroxy-3,6-bis[(2-hydroxy-5-nitro-3-sulfophenyl)diazenyl]naphthalene-2,7-disulfonic acid
InChI:
InChI=1S/C22H14N6O20S4/c29-19-10(3-8(27(33)34)5-14(19)51(43,44)45)23-25-17-12(49(37,38)39)1-7-2-13(50(40,41)42)18(22(32)16(7)21(17)31)26-24-11-4-9(28(35)36)6-15(20(11)30)52(46,47)48/h1-6,29-32H,(H,37,38,39)(H,40,41,42)(H,43,44,45)(H,46,47,48)
InChI Key:
ZABURINIBWWMEA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(N=Nc2c(O)c3c(cc2S(=O)(=O)O)cc(c(c3O)N=Nc2cc(cc(c2O)S(=O)(=O)O)[N+](=O)[O-])S(=O)(=O)O)c(c(c1)S(=O)(=O)O)O
Properties
Complexity:
1730
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
809.915g/mol
Formal Charge:
0
Heavy Atom Count:
52
Hydrogen Bond Acceptor Count:
24
Hydrogen Bond Donor Count:
8
Isotope Atom Count:
0
Molecular Weight:
810.616g/mol
Monoisotopic Mass:
809.915g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
473A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.