200,000+ products from a single source!
sales@angenechem.com
27678-26-8 | 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-9,10-dioxo-4-[[4-[2-(4-sulfophenyl)diazenyl]phenyl]amino]-, sodium salt (1:2)
CAS No: 27678-26-8 Catalog No: AG002UF3 MDL No:
Product Description
Catalog Number:
AG002UF3
Chemical Name:
2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-9,10-dioxo-4-[[4-[2-(4-sulfophenyl)diazenyl]phenyl]amino]-, sodium salt (1:2)
CAS Number:
27678-26-8
Molecular Formula:
C26H17N4Na2O8S2+
Molecular Weight:
623.5447
IUPAC Name:
disodium;1-imino-9,10-dioxo-4-[4-[2-(4-sulfonatophenyl)hydrazinyl]phenyl]iminoanthracene-2-sulfonate
InChI:
InChI=1S/C26H18N4O8S2.2Na/c27-24-21(40(36,37)38)13-20(22-23(24)26(32)19-4-2-1-3-18(19)25(22)31)28-14-5-7-15(8-6-14)29-30-16-9-11-17(12-10-16)39(33,34)35;;/h1-13,27,29-30H,(H,33,34,35)(H,36,37,38);;/q;2*+1/p-2
InChI Key:
OMLWFHPHRYYMRH-UHFFFAOYSA-L
SMILES:
O=C1c2ccccc2C(=O)c2c1c(N)c(cc2Nc1ccc(cc1)N=Nc1ccc(cc1)S(=O)(=O)O)S(=O)(=O)[O-].[Na+].[Na+]
EC Number:
248-600-3
Properties
Complexity:
1360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
622.02g/mol
Formal Charge:
0
Heavy Atom Count:
42
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
622.534g/mol
Monoisotopic Mass:
622.02g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
226A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.