1,4-Cyclohexanebis(methylamine), N,N'-bis(tert-butyl)-, dihydrochloride, (E)-
Basic information
- CAS
3949-61-9- Standard SMILES
CC(C)(C)NCC1CCC(CNC(C)(C)C)CC1.Cl.Cl- InChIKey
YIMVBDBJPQQKNE-UHFFFAOYSA-N- Molecular formula
- C16H36Cl2N2
- Average molar mass
- 327.4 g/mol
- Monoisotopic mass
- 326.2255545
Names & identifiers
- Preferred name
- 1,4-Cyclohexanebis(methylamine), N,N'-bis(tert-butyl)-, dihydrochloride, (E)-
- IUPAC
- N-[[4-[(tert-butylamino)methyl]cyclohexyl]methyl]-2-methylpropan-2-amine;dihydrochloride
Names & synonyms
1,4-Cyclohexanebis(methylamine), N,N'-bis(tert-butyl)-, dihydrochloride, (E)-3949-61-9DTXSID40192630tert-Butylamine, N,N'-(1,4-cyclohexylenedimethylene)di-, dihydrochloride, (E)-trans-N,N'-(1,4-Cyclohexylenedimethylene)di-tert-butylamine dihydrochloridetrans-N,N'-Bis(tert-butyl)-1,4-cyclohexanebis(methylamine) dihydrochlorideRefChem:220341DTXCID80115121N,N'-[Cyclohexane-1,4-diylbis(methylene)]bis(2-methylpropan-2-amine)--hydrogen chloride (1/2)
Database identifiers
- CAS
3949-61-9- PubChem CID
- 77556
- DTXSID
DTXSID40192630
Properties
Computed structural properties
- Topological polar surface area
- 24.1 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 200
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Related reactions
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Compound notes
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