Ethylenediamine, N,N-bis(2-chloroethyl)-N',N'-dicyclohexyl-, dihydrochloride
Basic information
- CAS
99000-04-1- Standard SMILES
ClCC[NH+](CCCl)CC[NH+](C1CCCCC1)C1CCCCC1.[Cl-].[Cl-]- InChIKey
AWAWJJZVXKGBQX-UHFFFAOYSA-N- Molecular formula
- C18H36Cl4N2
- Average molar mass
- 422.3 g/mol
- Monoisotopic mass
- 420.16326
Names & identifiers
- Preferred name
- Ethylenediamine, N,N-bis(2-chloroethyl)-N',N'-dicyclohexyl-, dihydrochloride
- IUPAC
- bis(2-chloroethyl)-[2-(dicyclohexylazaniumyl)ethyl]azanium dichloride
Names & synonyms
99000-04-1ETHYLENEDIAMINE, N,N-BIS(2-CHLOROETHYL)-N',N'-DICYCLOHEXYL-, DIHYDROCHLORIDERefChem:1085211N,N-Bis(2-chloroethyl)-N',N'-dicyclohexylethylenediamine dihydrochloride
Database identifiers
- CAS
99000-04-1- PubChem CID
- 57467
Properties
Computed structural properties
- Topological polar surface area
- 8.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 252
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