Basic information
- CAS
35859-44-0- Standard SMILES
CC[NH+](CC)CCOC(=O)CSc1ccc(Cl)cc1.[Cl-]- InChIKey
SGOFCKYJVQMSEE-UHFFFAOYSA-N- Molecular formula
- C14H21Cl2NO2S
- Average molar mass
- 338.3 g/mol
- Monoisotopic mass
- 337.0670055
Names & identifiers
- Preferred name
- Acetic acid, ((p-chlorophenyl)thio)-, 2-(diethylamino)ethyl ester, hydrochloride
- IUPAC
- 2-[2-(4-chlorophenyl)sulfanylacetyl]oxyethyl-diethylazanium chloride
Names & synonyms
((p-Chlorophenyl)thio)acetic acid 2-(diethylamino)ethyl ester hydrochloride35859-44-0Acetic acid, ((4-chlorophenyl)thio)-, 2-(diethylamino)ethyl ester, hydrochlorideACETIC ACID, ((p-CHLOROPHENYL)THIO)-, 2-(DIETHYLAMINO)ETHYL ESTER, HYDROCHLORIDERefChem:316087
Database identifiers
- CAS
35859-44-0- PubChem CID
- 37286
Properties
Computed structural properties
- Topological polar surface area
- 56 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 254
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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