Basic information
- CAS
54139-59-2- Standard SMILES
CN(C)S(=O)(=O)CCN(CCCl)CCCl.Cl- InChIKey
AUMQSQZDYJAVBN-UHFFFAOYSA-N- Molecular formula
- C8H19Cl3N2O2S
- Average molar mass
- 313.7 g/mol
- Monoisotopic mass
- 312.023282
Names & identifiers
- Preferred name
- Ethanesulfonamide, 2-(bis(2-chloroethyl)amino)-N,N-dimethyl-, monohydrochloride
- IUPAC
- 2-[bis(2-chloroethyl)amino]-N,N-dimethylethanesulfonamide;hydrochloride
Names & synonyms
Ethanesulfonamide, 2-(bis(2-chloroethyl)amino)-N,N-dimethyl-, monohydrochloride54139-59-22-(Bis(2-chloroethyl)amino)-N,N-dimethylethanesulfonamide monohydrochlorideDTXSID402024852-[Bis(2-chloroethyl)amino]-N,N-dimethylethane-1-sulfonamide--hydrogen chloride (1/1)
Database identifiers
- CAS
54139-59-2- PubChem CID
- 150261
- DTXSID
DTXSID40202485
Properties
Computed structural properties
- Topological polar surface area
- 49 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 246
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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