Basic information
- CAS
1155-70-0- Standard SMILES
C1CCC(NCC2CCC(CNC3CCCC3)CC2)C1.Cl.Cl- InChIKey
XIYZPVVABJHQTA-UHFFFAOYSA-N- Molecular formula
- C18H36Cl2N2
- Average molar mass
- 351.4 g/mol
- Monoisotopic mass
- 350.2255545
Names & identifiers
- Preferred name
- 1,4-Cyclohexanebis(methylamine), N,N'-dicyclopentyl-, dihydrochloride, (E)-
- IUPAC
- N-[[4-[(cyclopentylamino)methyl]cyclohexyl]methyl]cyclopentanamine;dihydrochloride
Names & synonyms
1155-70-01,4-Cyclohexanebis(methylamine), N,N'-dicyclopentyl-, dihydrochloride, (E)-(trans)-N,N'-(1,4-Cyclohexylenedimethylene)dicyclopentylamine dihydrochloride(trans)-N,N'-Dicyclopentyl-1,4-cyclohexanebis(methylamine) dihydrochlorideCyclopentylamine, N,N'-(1,4-cyclohexylenedimethylene)di-, dihydrochloride, (E)-RefChem:220346DTXSID20921743N,N'-[Cyclohexane-1,4-diylbis(methylene)]dicyclopentanamine--hydrogen chloride (1/2)
Database identifiers
- CAS
1155-70-0- PubChem CID
- 70869
- DTXSID
DTXSID20921743
Properties
Computed structural properties
- Topological polar surface area
- 24.1 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 231
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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