Basic information
- CAS
62592-76-1- Standard SMILES
COC(=O)C=CCCOS(C)(=O)=O- InChIKey
LTJTYWPDRQOIEI-UHFFFAOYSA-N- Molecular formula
- C7H12O5S
- Average molar mass
- 208.23 g/mol
- Monoisotopic mass
- 208.04054465
Names & identifiers
- Preferred name
- Methyl 5-methylsulfonyloxypent-2-enoate
- IUPAC
- methyl 5-methylsulfonyloxypent-2-enoate
Names & synonyms
62592-76-1methyl 5-methylsulfonyloxypent-2-enoateDTXSID60313325Methyl 5-[(methanesulfonyl)oxy]pent-2-enoate
Database identifiers
- CAS
62592-76-1- PubChem CID
- 320649
- DTXSID
DTXSID60313325
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 272
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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