Basic information
- CAS
126485-30-1- Standard SMILES
CCCOc1cc(N=Nc2ccc(N(CC)CC)cc2)ccc1N=Nc1c(S(=O)(=O)O)cc2ccc(N)cc2c1O- InChIKey
XYZWGXBGKRRUQA-UHFFFAOYSA-N- Molecular formula
- C29H32N6O5S
- Average molar mass
- 576.7 g/mol
- Monoisotopic mass
- 576.21548932
Names & identifiers
- Preferred name
- 2-Naphthalenesulfonic acid, 6-amino-3-((4-((4-(diethylamino)phenyl)azo)-2-propoxyphenyl)azo)-4-hydroxy-
- IUPAC
- 6-amino-3-[[4-[[4-(diethylamino)phenyl]diazenyl]-2-propoxyphenyl]diazenyl]-4-hydroxynaphthalene-2-sulfonic acid
Names & synonyms
126485-30-12-Naphthalenesulfonic acid, 6-amino-3-((4-((4-(diethylamino)phenyl)azo)-2-propoxyphenyl)azo)-4-hydroxy-(3E)-6-Amino-3-((4-(4-diethylaminophenyl)diazenyl-2-propoxyphenyl)hydrazinylidene)-4-oxo-naphthalene-2-sulfonic acid
Database identifiers
- CAS
126485-30-1- PubChem CID
- 147995
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 171 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 11
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 965
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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