Ethyl 2-(2-chloroethylsulfanyl)propanoate
Basic information
- Standard SMILES
CCOC(=O)C(C)SCCCl- InChIKey
YODCXZNVJRYLHI-UHFFFAOYSA-N- Molecular formula
- C7H13ClO2S
- Average molar mass
- 196.7 g/mol
- Monoisotopic mass
- 196.0324785
Names & identifiers
- Preferred name
- Ethyl 2-(2-chloroethylsulfanyl)propanoate
- IUPAC
- ethyl 2-(2-chloroethylsulfanyl)propanoate
Names & synonyms
NSC58806NSC-58806
Database identifiers
- PubChem CID
- 246174
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 119
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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