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Home > Nitro Compounds > 78265-88-0
78265-88-0 | 2,2'-[(2,4-dihydroxy-1,3-phenylene)bis(azo-4,1-phenyleneimino)]bis(5-nitrobenzenesulphonic) acid
CAS No: 78265-88-0 Catalog No: AG00GPLC MDL No:
Product Description
Catalog Number:
AG00GPLC
Chemical Name:
2,2'-[(2,4-dihydroxy-1,3-phenylene)bis(azo-4,1-phenyleneimino)]bis(5-nitrobenzenesulphonic) acid
CAS Number:
78265-88-0
IUPAC Name:
2-[4-[[2,4-dihydroxy-3-[[4-(4-nitro-2-sulfoanilino)phenyl]diazenyl]phenyl]diazenyl]anilino]-5-nitrobenzenesulfonic acid
InChI:
InChI=1S/C30H22N8O12S2/c39-26-14-13-25(35-33-19-5-1-17(2-6-19)31-23-11-9-21(37(41)42)15-27(23)51(45,46)47)30(40)29(26)36-34-20-7-3-18(4-8-20)32-24-12-10-22(38(43)44)16-28(24)52(48,49)50/h1-16,31-32,39-40H,(H,45,46,47)(H,48,49,50)
InChI Key:
PRTJMBOYQRLTOD-UHFFFAOYSA-N
EC Number:
278-876-0
Properties
Complexity:
1500
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
750.08g/mol
Formal Charge:
0
Heavy Atom Count:
52
Hydrogen Bond Acceptor Count:
18
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
750.67g/mol
Monoisotopic Mass:
750.08g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
331A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1
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