Azulenesulfonic acid
Basic information
- CAS
112504-30-0- Standard SMILES
O=S(=O)(O)c1ccc2cccccc1-2- InChIKey
KKEMWYNNTBRYMR-UHFFFAOYSA-N- Molecular formula
- C10H8O3S
- Average molar mass
- 208.24 g/mol
- Monoisotopic mass
- 208.01941529
Names & identifiers
- Preferred name
- Azulenesulfonic acid
- IUPAC
- azulene-1-sulfonic acid
Names & synonyms
Azulenesulfonic acid112504-30-0DTXSID30431464RefChem:320490DTXCID80382295Azulene-1-sulfonic AcidSCHEMBL140117SCHEMBL656528KKEMWYNNTBRYMR-UHFFFAOYSA-N
Database identifiers
- CAS
112504-30-0- PubChem CID
- 9834293
- DTXSID
DTXSID30431464
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 291
Related reactions
1 records
Compound notes
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