Ethylenediamine, N,N'-bis(2-chloroethyl)-N,N'-dimethyl-, N,N'-dioxide
Basic information
- CAS
101418-40-0- Standard SMILES
C[N+]([O-])(CCCl)CC[N+](C)([O-])CCCl- InChIKey
UAKYUCSKPCUGMX-UHFFFAOYSA-N- Molecular formula
- C8H18Cl2N2O2
- Average molar mass
- 245.14 g/mol
- Monoisotopic mass
- 244.0745332
Names & identifiers
- Preferred name
- Ethylenediamine, N,N'-bis(2-chloroethyl)-N,N'-dimethyl-, N,N'-dioxide
- IUPAC
- N,N'-bis(2-chloroethyl)-N,N'-dimethylethane-1,2-diamine oxide
Names & synonyms
101418-40-0ETHYLENEDIAMINE, N,N'-BIS(2-CHLOROETHYL)-N,N'-DIMETHYL-, N,N'-DIOXIDERefChem:1085205BRN 1787244N,N'-Bis(2-chloroethyl)-N,N'-dimethylethylenediamine N,N'-dioxideDTXSID40906173N~1~,N~2~-Bis(2-chloroethyl)-N~1~,N~2~-dimethylethane-1,2-diamine N-oxide
Database identifiers
- CAS
101418-40-0- PubChem CID
- 58349
- DTXSID
DTXSID40906173- Nikkaji
- J93.022I
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 36.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 155
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Compound notes
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