Disodium 2-(1-ethyl-3-(4,5-dichloro-2-methylphenyl)-2-trienyl)-5-sulphonatobenzoate
Basic information
- CAS
85283-62-1- Standard SMILES
CCN(N=Nc1cc(Cl)c(Cl)cc1C)c1ccc(S(=O)(=O)[O-])cc1C(=O)[O-].[Na+].[Na+]- InChIKey
UCRGXBHSNPEDSC-UHFFFAOYSA-L- Molecular formula
- C16H13Cl2N3Na2O5S
- Average molar mass
- 476.2 g/mol
- Monoisotopic mass
- 474.9748356
Names & identifiers
- Preferred name
- Disodium 2-(1-ethyl-3-(4,5-dichloro-2-methylphenyl)-2-trienyl)-5-sulphonatobenzoate
- IUPAC
- disodium;2-[[(4,5-dichloro-2-methylphenyl)diazenyl]-ethylamino]-5-sulfonatobenzoate
Names & synonyms
EINECS 286-590-285283-62-1Disodium 2-(1-ethyl-3-(4,5-dichloro-2-methylphenyl)-2-trienyl)-5-sulphonatobenzoateUCRGXBHSNPEDSC-UHFFFAOYSA-LDTXSID801374733Benzoic acid, 2-[3-(4,5-dichloro-2-methylphenyl)-1-ethyl-2-triazen-1-yl]-5-sulfo-, sodium salt (1:2)
Database identifiers
- CAS
85283-62-1- PubChem CID
- 102438147
- DTXSID
DTXSID801374733- EC Number
- 286-590-2
- Nikkaji
- J307.639C
Properties
Computed structural properties
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 638
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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