- InChI
- InChI=1S/C12H12/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-2,7-10H2
- InChI Key
- PYXWKTZVNXGDJK-UHFFFAOYSA-N
- Formula
- C12H12
- SMILES
- C1#CCCC#CCCC#CCC1
- Molecular Weight1
- 156.22
- CAS
- 60323-50-4
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| IE | [9.00; 9.24] | eV |
|
| IE | 9.00 | eV | NIST |
| IE | 9.24 | eV | NIST |
| log10WS | -4.12 | Crippen Calculated Property | |
| logPoct/wat | 2.351 | Crippen Calculated Property | |
| McVol | 143.280 | ml/mol | McGowan Calculated Property |
Similar Compounds
Find more compounds similar to 1,5,9-Cyclododecatriyne.
Sources
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