Basic information
- Standard SMILES
Cc1ccc(S(=O)(=O)OCC2CC=CC2)cc1- InChIKey
ZKZNEHVKHYJJCK-UHFFFAOYSA-N- Molecular formula
- C13H16O3S
- Average molar mass
- 252.33 g/mol
Names & identifiers
- Preferred name
- (Cyclopent-3-en-1-yl)methyl para-toluenesulfonate
- IUPAC
- cyclopent-3-en-1-ylmethyl 4-methylbenzenesulfonate
Names & synonyms
SCHEMBL1266490(cyclopent-3-enyl)methyl tosylateZKZNEHVKHYJJCK-UHFFFAOYSA-NCyclopent-3-en-1-ylmethyl TosylateSY464051(cyclopent-3-en-1-yl)methyl para-toluenesulfonate
Database identifiers
- PubChem CID
- 12930331
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 351
Related reactions
1 records
Compound notes
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