Basic information
- Standard SMILES
COC(=O)CN(SC(Cl)(Cl)C(Cl)Cl)S(=O)(=O)C1CCCCC1- InChIKey
HTDDUKLPXNFJRO-UHFFFAOYSA-N- Molecular formula
- C11H17Cl4NO4S2
- Average molar mass
- 433.2 g/mol
- Monoisotopic mass
- 430.935311
Names & identifiers
- Preferred name
- N-methoxycarbonylmethyl-N-(1,1,2,2-tetrachloroethylthio)cyclohexanesulfonamide
- IUPAC
- methyl 2-[cyclohexylsulfonyl(1,1,2,2-tetrachloroethylsulfanyl)amino]acetate
Names & synonyms
SCHEMBL11309088HTDDUKLPXNFJRO-UHFFFAOYSA-NN-methoxycarbonylmethyl-N-(1,1,2,2-tetrachloroethylthio)cyclohexanesulfonamide
Database identifiers
- PubChem CID
- 20575290
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 97.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 475
Related reactions
4 records
Compound notes
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