- InChI
- InChI=1S/C6H5Cl3Si/c7-10(8,9)6-4-2-1-3-5-6/h1-5H
- InChI Key
- ORVMIVQULIKXCP-UHFFFAOYSA-N
- Formula
- C6H5Cl3Si
- SMILES
- Cl[Si](Cl)(Cl)c1ccccc1
- Molecular Weight1
- 211.55
- CAS
- 98-13-5
- Other Names
-
- CP0280
- Phenylsilicon trichloride
- Silane, phenyltrichloro-
- Silane, trichlorophenyl-
- Silicon phenyl trichloride
- Trichlorophenylsilane
- UN 1804
- ω : Acentric Factor.
- Cp,liquid : Liquid phase 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 a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- Pc : Critical Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- S°liquid : Liquid phase molar entropy at standard conditions (J/mol×K).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Ttriple : Triple Point Temperature (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 | 0.2447 | Relay (1.0) Calculated Property | |
| ΔfG° | 137.92 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -97.79 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 51.34 | kJ/mol | Relay (1.0) Calculated Property |
| IE | [9.10; 9.55] | eV |
|
| IE | 9.10 | eV | NIST |
| IE | 9.55 | eV | NIST |
| log10WS | -3.49 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.549 | Crippen Calculated Property | |
| Pc | 2913.19 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [1144.00; 1144.00] |
|
|
| Inp | 1144.00 | NIST | |
| Inp | 1144.00 | NIST | |
| S°liquid | 314.70 | J/mol×K | NIST |
| Tboil | 474.00 | K | NIST |
| Tc | 701.27 | K | Relay (1.0) Calculated Property |
| Tfus | 214.92 | K | Relay (1.0) Calculated Property |
| Ttriple | 233.40 ± 0.20 | K | NIST |
| Vc | 0.458 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,liquid | 220.70 | J/mol×K | 298.15 | NIST |
| ΔfusH | [11.66; 11.66] | kJ/mol | [233.40; 233.40] |
|
| ΔfusH | 11.66 | kJ/mol | 233.40 | NIST |
| ΔfusH | 11.66 | kJ/mol | 233.40 | NIST |
| ΔfusH | 11.66 | kJ/mol | 233.40 | NIST |
| ΔvapH | [47.90; 51.10] | kJ/mol | [393.00; 422.50] |
|
| ΔvapH | 51.10 | kJ/mol | 393.00 | NIST |
| ΔvapH | 47.90 | kJ/mol | 422.50 | NIST |
| ΔfusS | 49.96 | J/mol×K | 233.40 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [350.12; 505.81] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.45369e+01 | |||
| Coefficient B | -4.07367e+03 | |||
| Coefficient C | -6.42400e+01 | |||
| Temperature range, min. | 350.12 | |||
| Temperature range, max. | 505.81 | |||
| Pvap | 1.33 | kPa | 350.12 | Calculated Property |
| Pvap | 3.01 | kPa | 367.42 | Calculated Property |
| Pvap | 6.21 | kPa | 384.72 | Calculated Property |
| Pvap | 11.90 | kPa | 402.02 | Calculated Property |
| Pvap | 21.42 | kPa | 419.32 | Calculated Property |
| Pvap | 36.50 | kPa | 436.61 | Calculated Property |
| Pvap | 59.32 | kPa | 453.91 | Calculated Property |
| Pvap | 92.50 | kPa | 471.21 | Calculated Property |
| Pvap | 139.12 | kPa | 488.51 | Calculated Property |
| Pvap | 202.66 | kPa | 505.81 | Calculated Property |
Similar Compounds
Find more compounds similar to Phenyl trichlorosilane.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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