1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(cyclohexylmethyl)-, dihydrochloride
Basic information
- CAS
2169-39-3- Standard SMILES
C1CCC(C[NH2+]CC2CC3CCC2CC3C[NH2+]CC2CCCCC2)CC1.[Cl-].[Cl-]- InChIKey
LNMLHGDTVHDNQV-UHFFFAOYSA-N- Molecular formula
- C24H46Cl2N2
- Average molar mass
- 433.5 g/mol
- Monoisotopic mass
- 432.3038049
Names & identifiers
- Preferred name
- 1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(cyclohexylmethyl)-, dihydrochloride
- IUPAC
- cyclohexylmethyl-[[5-[(cyclohexylmethylazaniumyl)methyl]-2-bicyclo[2.2.2]octanyl]methyl]azanium dichloride
Names & synonyms
1,4-Bicyclo(2.2.2)octanebis(methylamine), N,N'-bis(cyclohexylmethyl)-, dihydrochloride2169-39-3Cyclohexanemethylamine, N,N'-(1,4-bicyclo(2.2.2)octylenedimethylene)bis-, dihydrochlorideN,N'-(1,4-Bicyclo(2.2.2)octylenedimethylene)bis(cyclohexanemethylamine) dihydrochlorideN,N'-Bis(cyclohexylmethyl)-1,4-bicyclo(2.2.2)octanebis(methylamine) dihydrochlorideRefChem:220142
Database identifiers
- CAS
2169-39-3- PubChem CID
- 16569
Properties
Computed structural properties
- Topological polar surface area
- 33.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 359
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…