Basic information
- CAS
89211-06-3- Standard SMILES
O=S(=O)(c1ccccc1)C1OC12CC1CCC2C1- InChIKey
CGRCNOGGLVDXLR-UHFFFAOYSA-N- Molecular formula
- C14H16O3S
- Average molar mass
- 264.34 g/mol
- Monoisotopic mass
- 264.08201554
Names & identifiers
- Preferred name
- 3'-(Benzenesulfonyl)spiro[bicyclo[2.2.1]heptane-2,2'-oxirane]
- IUPAC
- 3'-(benzenesulfonyl)spiro[bicyclo[2.2.1]heptane-2,2'-oxirane]
Names & synonyms
89211-06-3DTXSID207523973'-(Benzenesulfonyl)spiro[bicyclo[2.2.1]heptane-2,2'-oxirane]
Database identifiers
- CAS
89211-06-3- PubChem CID
- 71322746
- DTXSID
DTXSID20752397
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 446
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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