1,9-Nonanediamine, N,N'-bis(2-chloroethyl)-N,N'-dimethyl-, N,N'-dioxide
Basic information
- CAS
101832-23-9- Standard SMILES
C[N+]([O-])(CCCl)CCCCCCCCC[N+](C)([O-])CCCl- InChIKey
CFOJNHPHERTFRV-UHFFFAOYSA-N- Molecular formula
- C15H32Cl2N2O2
- Average molar mass
- 343.3 g/mol
- Monoisotopic mass
- 342.1840837
Names & identifiers
- Preferred name
- 1,9-Nonanediamine, N,N'-bis(2-chloroethyl)-N,N'-dimethyl-, N,N'-dioxide
- IUPAC
- N,N'-bis(2-chloroethyl)-N,N'-dimethylnonane-1,9-diamine oxide
Names & synonyms
101832-23-91,9-NONANEDIAMINE, N,N'-BIS(2-CHLOROETHYL)-N,N'-DIMETHYL-, N,N'-DIOXIDERefChem:1053605BRN 1714493N,N'-Bis(2-chloroethyl)-N,N'-dimethyl-1,9-nonanediamine N,N'-dioxideDTXSID80906677N~1~,N~9~-Bis(2-chloroethyl)-N~1~,N~9~-dimethylnonane-1,9-diamine N-oxide
Database identifiers
- CAS
101832-23-9- PubChem CID
- 58983
- DTXSID
DTXSID80906677- Nikkaji
- J64.699G
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 36.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 14
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 236
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Compound notes
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