- InChI
- InChI=1S/C6H13NS2/c1-4-7-5(2)9-6(3)8-4/h4-7H,1-3H3
- InChI Key
- FBMVFHKKLDGLJA-UHFFFAOYSA-N
- Formula
- C6H13NS2
- SMILES
- CC1NC(C)SC(C)S1
- Molecular Weight1
- 163.30
- Other Names
-
- 5,6-dihydro-2,4,6-trimethyl-4H-1,3,5-dithiazine, A
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- 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).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.2798 | Relay (... Calculated Property | |
| ΔfG° | 176.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -84.48 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 22.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.18 | kJ/mol | Relay (... Calculated Property |
| IE | 8.29 | eV | Relay (... Calculated Property |
| log10WS | -1.63 | Relay (... Calculated Property | |
| logPoct/wat | 2.094 | Crippen Calculated Property | |
| McVol | 127.220 | ml/mol | McGowan Calculated Property |
| Pc | 3708.97 | kPa | Joback Calculated Property |
| Inp | 1174.00 | NIST | |
| Tboil | 486.25 | K | Relay (... Calculated Property |
| Tc | 696.76 | K | Relay (... Calculated Property |
| Tfus | 357.75 | K | Relay (... Calculated Property |
| Vc | 0.424 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [267.18; 352.89] | J/mol×K | [491.10; 736.07] | 
|
| Cp,gas | 267.18 | J/mol×K | 491.10 | Joback Calculated Property |
| Cp,gas | 283.57 | J/mol×K | 531.93 | Joback Calculated Property |
| Cp,gas | 299.12 | J/mol×K | 572.76 | Joback Calculated Property |
| Cp,gas | 313.83 | J/mol×K | 613.58 | Joback Calculated Property |
| Cp,gas | 327.70 | J/mol×K | 654.41 | Joback Calculated Property |
| Cp,gas | 340.72 | J/mol×K | 695.24 | Joback Calculated Property |
| Cp,gas | 352.89 | J/mol×K | 736.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3,5-Dithiazine, perhydro, 2,4,6-trimethyl, #1.
Sources
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