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72749-86-1 | 5-[[2,4-Dihydroxy-5-[(2-hydroxy-3,5-dinitrophenyl)azo]-3-[(4-nitrophenyl)azo]phenyl]azo]-4-hydroxy-3-[(4-nitrophenyl)azo]-2,7-naphthalenedisulfonic acid disodium salt
CAS No: 72749-86-1 Catalog No: AG00FP3O MDL No:
Product Description
Catalog Number:
AG00FP3O
Chemical Name:
5-[[2,4-Dihydroxy-5-[(2-hydroxy-3,5-dinitrophenyl)azo]-3-[(4-nitrophenyl)azo]phenyl]azo]-4-hydroxy-3-[(4-nitrophenyl)azo]-2,7-naphthalenedisulfonic acid disodium salt
CAS Number:
72749-86-1
IUPAC Name:
disodium;5-[[2,4-dihydroxy-5-[(2-hydroxy-3,5-dinitrophenyl)diazenyl]-3-[(4-nitrophenyl)diazenyl]phenyl]diazenyl]-4-hydroxy-3-[(4-nitrophenyl)diazenyl]naphthalene-2,7-disulfonate
InChI:
InChI=1S/C34H20N12O18S2.2Na/c47-31-23(11-20(45(55)56)12-26(31)46(57)58)38-40-25-14-24(32(48)30(33(25)49)42-36-17-3-7-19(8-4-17)44(53)54)39-37-22-13-21(65(59,60)61)9-15-10-27(66(62,63)64)29(34(50)28(15)22)41-35-16-1-5-18(6-2-16)43(51)52;;/h1-14,47-50H,(H,59,60,61)(H,62,63,64);;/q;2*+1/p-2
InChI Key:
KUSCSGABLVTDOR-UHFFFAOYSA-L
Properties
Complexity:
2080
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
992.01g/mol
Formal Charge:
0
Heavy Atom Count:
68
Hydrogen Bond Acceptor Count:
26
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
992.684g/mol
Monoisotopic Mass:
992.01g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
494A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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