1,3-Cyclopentanebis(methylamine), N,N'-bis(2-chlorobenzyl)-1,2,2-trimethyl-, dihydrochloride, (E)-
Basic information
- CAS
67239-07-0- Standard SMILES
CC1C(C)(CNCc2ccccc2Cl)CCC1(C)CNCc1ccccc1Cl.Cl.Cl- InChIKey
XWQVNMDTCHAEKU-UHFFFAOYSA-N- Molecular formula
- C24H34Cl4N2
- Average molar mass
- 492.3 g/mol
- Monoisotopic mass
- 490.14761
Names & identifiers
- Preferred name
- 1,3-Cyclopentanebis(methylamine), N,N'-bis(2-chlorobenzyl)-1,2,2-trimethyl-, dihydrochloride, (E)-
- IUPAC
- 1-(2-chlorophenyl)-N-[[3-[[(2-chlorophenyl)methylamino]methyl]-1,2,3-trimethylcyclopentyl]methyl]methanamine;dihydrochloride
Names & synonyms
1,3-Cyclopentanebis(methylamine), N,N'-bis(2-chlorobenzyl)-1,2,2-trimethyl-, dihydrochloride, (E)-67239-07-0RefChem:218237DTXSID60986396N,N'-[(1,2,3-Trimethylcyclopentane-1,3-diyl)bis(methylene)]bis[1-(2-chlorophenyl)methanamine]--hydrogen chloride (1/2)
Database identifiers
- CAS
67239-07-0- PubChem CID
- 3051024
- DTXSID
DTXSID60986396
Properties
Computed structural properties
- Topological polar surface area
- 24.1 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 445
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Compound notes
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