Basic information
- CAS
25705-30-0- Standard SMILES
Cc1cc(N=Nc2c(O)ccc3ccccc23)ccc1S(=O)(=O)O- InChIKey
CVHRCIIWBOITNQ-UHFFFAOYSA-N- Molecular formula
- C17H14N2O4S
- Average molar mass
- 342.4 g/mol
- Monoisotopic mass
- 342.06742811
Names & identifiers
- Preferred name
- C5Skp97smc
- IUPAC
- 4-[(2-hydroxynaphthalen-1-yl)diazenyl]-2-methylbenzenesulfonic acid
Names & synonyms
C5SKP97SMCUNII-C5SKP97SMC25705-30-0Benzenesulfonic acid, 4-((2-hydroxy-1-naphthalenyl)azo)-2-methyl-4-(2-(2-Hydroxy-1-naphthalenyl)diazenyl)-2-methylbenzenesulfonic acidBenzenesulfonic acid, 4-(2-(2-hydroxy-1-naphthalenyl)diazenyl)-2-methyl-SCHEMBL8947444SCHEMBL10021592
Database identifiers
- CAS
25705-30-0- PubChem CID
- 79947
- UNII
- C5SKP97SMC
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 559
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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