N-(4-Aminocyclohexyl)-1,4-cyclohexanediamine
Basic information
- CAS
5123-26-2- Standard SMILES
NC1CCC(NC2CCC(N)CC2)CC1- InChIKey
VBPWZDGHWDCOII-UHFFFAOYSA-N- Molecular formula
- C12H25N3
- Average molar mass
- 211.35 g/mol
- Monoisotopic mass
- 211.20484781
Names & identifiers
- Preferred name
- N-(4-Aminocyclohexyl)-1,4-cyclohexanediamine
- IUPAC
- 4-N-(4-aminocyclohexyl)cyclohexane-1,4-diamine
- English name
- N-(4-Aminocyclohexyl)-1,4-cyclohexanediamine
- Molecular formula
- C12H25N3
- Molecular weight
- 211.35
Names & synonyms
N-(4-Aminocyclohexyl)-1,4-cyclohexanediamine5123-26-24-N-(4-aminocyclohexyl)cyclohexane-1,4-diamineN4-(4-aminocyclohexyl)cyclohexane-1,4-diamineSCHEMBL933210CHEMBL3040057DTXSID80329084AKOS015894531N~1~-(4-Aminocyclohexyl)cyclohexane-1,4-diamine4,4'-Iminobiscyclohexylamine4,4'-DiaminodicyclohexylamineN1-(4-Aminocyclohexyl)-1,4-cyclohexanediamine
Show more names
1,4-Cyclohexanediamine, N1-(4-aminocyclohexyl)-
Database identifiers
- CAS
5123-26-2- PubChem CID
- 417227
- DTXSID
DTXSID80329084- ChEMBL
CHEMBL3040057- Nikkaji
- J1.137.185J
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 64.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 159
Physicochemical properties
- Density
- 1.02 · 1.02
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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