- InChI
- InChI=1S/C11H21NS/c1-2-3-4-5-6-7-8-9-10-12-11-13/h2-10H2,1H3
- InChI Key
- HFWWGJSMDPUEFD-UHFFFAOYSA-N
- Formula
- C11H21NS
- SMILES
- CCCCCCCCCCN=C=S
- Molecular Weight1
- 199.36
- CAS
- 24540-94-1
- Other Names
-
- Decane, 1-isothiocyanato-
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | 13.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.52 | kJ/mol | Joback Calculated Property |
| log10WS | -4.36 | Crippen Calculated Property | |
| logPoct/wat | 4.230 | Crippen Calculated Property | |
| McVol | 183.580 | ml/mol | McGowan Calculated Property |
| Pc | 1971.80 | kPa | Joback Calculated Property |
| Inp | 1564.00 | NIST | |
| I | 1984.00 | NIST | |
| Tboil | 597.03 | K | Joback Calculated Property |
| Tc | 795.95 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Decyl isothiocyanate.
Sources
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