Basic information
- CAS
2812-73-9- Standard SMILES
CCOC(=S)Cl- InChIKey
GRSBAMVBFWRBBH-UHFFFAOYSA-N- Molecular formula
- C3H5ClOS
- Average molar mass
- 124.59 g/mol
Overview
See also: Carbonochloridothioic acid, O-ethyl ester (annotation moved to).
Names & identifiers
- Preferred name
- O-ethyl chloromethanethioate
- IUPAC
- O-ethyl chloromethanethioate
Names & synonyms
2812-73-9EthylchlorothioformateO-ethyl chloromethanethioateETHYL CHLOROMETHANETHIOATEEthylchlorthioformiatCarbonochloridothioicacid, O-ethyl esterethyl chlorothiocarbonateSCHEMBL697915chloro-methanethioic acid O-ethyl esterEN300-7271499InChI=1/C3H5ClOS/c1-2-5-3(4)6/h2H2,1H
Database identifiers
- CAS
2812-73-9- PubChem CID
- 5325481
- Nikkaji
- J34.718C
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 41.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 54.8
Related reactions
16 records
Compound notes
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