Basic information
- CAS
73735-36-1- Standard SMILES
COc1ccc(CCOS(C)(=O)=O)cc1- InChIKey
ORTPEEDBOZIXNC-UHFFFAOYSA-N- Molecular formula
- C10H14O4S
- Average molar mass
- 230.28 g/mol
- Monoisotopic mass
- 230.06127993
Names & identifiers
- Preferred name
- 2-(4-Methoxyphenyl)ethyl methanesulfonate
- IUPAC
- 2-(4-methoxyphenyl)ethyl methanesulfonate
Names & synonyms
2-(4-methoxyphenyl)ethyl methanesulfonate73735-36-1NSC127061SCHEMBL1845745DTXSID30994620ORTPEEDBOZIXNC-UHFFFAOYSA-N4-methoxyphenethyl methanesulfonateNSC-127061DB-129004[2-(4-methoxyphenyl)ethyl] methanesulfonate1-methanesulfonyloxy-2-(4-methoxyphenyl)ethane
Database identifiers
- CAS
73735-36-1- PubChem CID
- 277977
- DTXSID
DTXSID30994620
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 61 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 260
Related reactions
7 records
Compound notes
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