Basic information
- CAS
2056-21-5- Standard SMILES
Clc1ccccc1C[NH2+]CCCCCC[NH2+]Cc1ccccc1Cl.[Cl-].[Cl-]- InChIKey
YMCXHQCNURJAPH-UHFFFAOYSA-N- Molecular formula
- C20H28Cl4N2
- Average molar mass
- 438.3 g/mol
- Monoisotopic mass
- 436.10066
Names & identifiers
- Preferred name
- Hexamethylenediamine, N,N'-bis(o-chlorobenzyl)-, dihydrochloride
- IUPAC
- (2-chlorophenyl)methyl-[6-[(2-chlorophenyl)methylazaniumyl]hexyl]azanium dichloride
Names & synonyms
N,N'-Hexamethylenebis(2-chlorobenzylamine) dihydrochloride2056-21-5N,N'-Bis(o-chlorobenzyl)hexamethylenediamine dihydrochlorideBenzylamine, N,N'-hexamethylenebis(2-chloro-, dihydrochlorideHEXAMETHYLENEDIAMINE, N,N'-BIS(o-CHLOROBENZYL)-, DIHYDROCHLORIDERefChem:347565
Database identifiers
- CAS
2056-21-5- PubChem CID
- 16339
Properties
Computed structural properties
- Topological polar surface area
- 33.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 284
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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