Basic information
- CAS
6330-90-1- Standard SMILES
Cc1cc(N=Nc2ccc(-c3ccc(N=Nc4ccc(O)c(C(=O)O)c4)cc3)cc2)c(C)cc1N- InChIKey
BETDIULUXNWVLT-UHFFFAOYSA-N- Molecular formula
- C27H23N5O3
- Average molar mass
- 465.5 g/mol
- Monoisotopic mass
- 465.18008961
Names & identifiers
- Preferred name
- 5-((4'-((4-Amino-2,5-dimethylphenyl)diazenyl)(1,1'-biphenyl)-4-yl)diazenyl)-2-hydroxybenzoic acid
- IUPAC
- 5-[[4-[4-[(4-amino-2,5-dimethylphenyl)diazenyl]phenyl]phenyl]diazenyl]-2-hydroxybenzoic acid
Names & synonyms
6330-90-1NSC 456105-((4'-((4-Amino-2,5-dimethylphenyl)diazenyl)(1,1'-biphenyl)-4-yl)diazenyl)-2-hydroxybenzoic acidNSC456105-((4'-((4-Amino-2,5-dimethylphenyl)diazenyl)[1,1'-biphenyl]-4-yl)diazenyl)-2-hydroxybenzoic acid5-[(E)-[4-[4-[(E)-(4-amino-2,5-dimethyl-phenyl)azo]phenyl]phenyl]azo]-2-hydroxy-benzoic acid
Database identifiers
- CAS
6330-90-1- PubChem CID
- 413237
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 133 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 745
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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