4,4'-Bis((5-arsono-2,4-dihydroxyphenyl)diazenyl)-1,1'-biphenyl
Basic information
- CAS
7145-97-3- Standard SMILES
O=[As](O)(O)c1cc(N=Nc2ccc(-c3ccc(N=Nc4cc([As](=O)(O)O)c(O)cc4O)cc3)cc2)c(O)cc1O- InChIKey
FJBJBBIFICYJMB-UHFFFAOYSA-N- Molecular formula
- C24H20As2N4O10
- Average molar mass
- 674.3 g/mol
- Monoisotopic mass
- 673.96113
Names & identifiers
- Preferred name
- 4,4'-Bis((5-arsono-2,4-dihydroxyphenyl)diazenyl)-1,1'-biphenyl
- IUPAC
- [5-[[4-[4-[(5-arsono-2,4-dihydroxyphenyl)diazenyl]phenyl]phenyl]diazenyl]-2,4-dihydroxyphenyl]arsonic acid
- English name
- 4,4'-Bis((5-arsono-2,4-dihydroxyphenyl)diazenyl)-1,1'-biphenyl
- Molecular formula
- C24H20As2N4O10
- Molecular weight
- 674.28
Names & synonyms
7145-97-34,4'-Bis((5-arsono-2,4-dihydroxyphenyl)diazenyl)-1,1'-biphenylNSC15600NSC 15600NSC-15600ANTINEOPLASTIC-15600TS28WGD4K8CHEMBL1968005DTXSID001333975NCI60_001110[5-[(E)-[4-[4-[(E)-(5-arsono-2,4-dihydroxy-phenyl)azo]phenyl]phenyl]azo]-2,4-dihydroxy-phenyl]arsonic acid{[1,1'-Biphenyl]-4,4'-diylbis[(diazene-2,1-diyl)(4,6-dihydroxy-3,1-phenylene)]}bis(arsonic acid)
Show more names
[(3Z)-3-[[4-[4-[(2E)-2-(3-arsono-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)hydrazinyl]phenyl]phenyl]hydrazinylidene]-6-hydroxy-4-oxocyclohexa-1,5-dien-1-yl]arsonic acid
5-((4'-((5-Arsono-2,4-dihydroxyphenyl)diazenyl)[1,1'-biphenyl]-4-yl)diazenyl)-2,4-dihydroxyphenylarsonic acidArsonic acid, As,As'-[[1,1'-biphenyl]-4,4'-diylbis[2,1-diazenediyl(4,6-dihydroxy-3,1-phenylene)]]bis-As,As'-[[1,1'-Biphenyl]-4,4'-diylbis[2,1-diazenediyl(4,6-dihydroxy-3,1-phenylene)]]bis[arsonic acid]
Database identifiers
- CAS
7145-97-3
Properties
Computed structural properties
- Topological polar surface area
- 245 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 7
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 914
Physicochemical properties
- Boiling point
- 1107.732 · 1107.732±75.00 °C(Press: 760.00 Torr)(predicted)
- pka
- 3.857 · 3.857±0.16(predicted)
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Compound notes
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