1-Cyanonaphthalene-2-sulfonic acid
Basic information
- CAS
411237-01-9- Standard SMILES
N#Cc1c(S(=O)(=O)O)ccc2ccccc12- InChIKey
ONUTVURHFSOAFS-UHFFFAOYSA-N- Molecular formula
- C11H7NO3S
- Average molar mass
- 233.24 g/mol
- Monoisotopic mass
- 233.01466426
Names & identifiers
- Preferred name
- 1-Cyanonaphthalene-2-sulfonic acid
- IUPAC
- 1-cyanonaphthalene-2-sulfonic acid
- English name
- 1-Cyanonaphthalene-2-sulfonic acid
- Molecular formula
- C11H7NO3S
- Molecular weight
- 233.24318
Names & synonyms
1-Cyanonaphthalene-2-sulfonic acid411237-01-9SCHEMBL27493530DTXSID90704782DB-084022
Database identifiers
- CAS
411237-01-9- PubChem CID
- 53485697
- DTXSID
DTXSID90704782
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 86.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 403
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Compound notes
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