Basic information
- CAS
126485-28-7- Standard SMILES
CCN(CC)c1ccc(N=Nc2ccc(N=Nc3c(S(=O)(=O)O)cc4ccc(N)cc4c3O)c(OC)c2)cc1- InChIKey
UICBPWFXDJWDQQ-UHFFFAOYSA-N- Molecular formula
- C27H28N6O5S
- Average molar mass
- 548.6 g/mol
- Monoisotopic mass
- 548.18418919
Names & identifiers
- Preferred name
- 2-Naphthalenesulfonic acid, 6-amino-3-((4-((4-(diethylamino)phenyl)azo)-2-methoxyphenyl)azo)-4-hydroxy-
- IUPAC
- 6-amino-3-[[4-[[4-(diethylamino)phenyl]diazenyl]-2-methoxyphenyl]diazenyl]-4-hydroxynaphthalene-2-sulfonic acid
Names & synonyms
126485-28-72-Naphthalenesulfonic acid, 6-amino-3-((4-((4-(diethylamino)phenyl)azo)-2-methoxyphenyl)azo)-4-hydroxy-
Database identifiers
- CAS
126485-28-7- PubChem CID
- 147993
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 171 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 9
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 933
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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