Basic information
- CAS
93958-64-6- Standard SMILES
CC(Cl)=NS(=O)(=O)c1ccc(C)cc1- InChIKey
XRVVHEXJOALLIM-UHFFFAOYSA-N- Molecular formula
- C9H10ClNO2S
- Average molar mass
- 231.7 g/mol
- Monoisotopic mass
- 231.0120774
Names & identifiers
- Preferred name
- Ethanimidoyl chloride, N-[(4-methylphenyl)sulfonyl]-
- IUPAC
- N-(4-methylphenyl)sulfonylethanimidoyl chloride
Names & synonyms
Ethanimidoyl chloride, N-[(4-methylphenyl)sulfonyl]-93958-64-6DTXSID10403669N-(4-Methylbenzene-1-sulfonyl)ethanimidoyl chloride
Database identifiers
- CAS
93958-64-6- PubChem CID
- 4487014
- DTXSID
DTXSID10403669
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 54.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 310
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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