dodecane-1,12-diamine dihydrochloride | SBID = 2595 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 55.3 | ||
| Ertl TPSA/Å2: | 125.28 | ||
| Hydrophilicity (PubChem XLogP): | |||
| Hydrophilicity (Cheng XLogP3): | 0.8 | ||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 2.0 | ||
| Number of H-Bond Acceptors: | 2.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 0.0 | ||
| 3D Volume/Å3: | |||
| Sum Formula: | C12H30Cl2N2 | ||
| M / g/mol: | 273.28 | ||
| Complexity: | 82.0 | ||
| Number of Conformers: | 0.0 |
Identifiers
- Tags:
- Name: dodecane-1,12-diamine dihydrochloride
- Preferred Abbreviation: 1,12-DODECANEDIAMINE, DIHYDROCHLORIDE
- IUPAC Name: 12-azaniumyldodecylazanium;dichloride
- CAS:
- CID: 27371
- InChiKey: DQHSCIUBPDTNLX-UHFFFAOYSA-N
- InChi: InChI=1S/C12H28N2.2ClH/c13-11-9-7-5-3-1-2-4-6-8-10-12-14;;/h1-14H2;2*1H
- CanoSmiles: C(CCCCCC[NH3+])CCCCC[NH3+].[Cl-].[Cl-]
- IsoSmiles: C(CCCCCC[NH3+])CCCCC[NH3+].[Cl-].[Cl-]
