- InChI
- InChI=1S/C10H13NO2/c11-10(12)13-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H2,11,12)
- InChI Key
- CAMYKONBWHRPDD-UHFFFAOYSA-N
- Formula
- C10H13NO2
- SMILES
- NC(=O)OCCCc1ccccc1
- Molecular Weight1
- 179.22
- CAS
- 673-31-4
- Other Names
-
- Benzenepropanol, carbamate
- «gamma»-Phenylpropyl carbamate
- Actiphan
- Actozine
- Ansepron
- Carbamic acid, 3-phenylpropyl ester
- Eirenal
- Extacol
- Fenprobamato
- Gamaquil
- HG 532
- MH 532
- Nelaxan
- Palmita
- Phenoprobamate
- Proformiphen
- Qumamquil
- Spantol
- Tranquil
- 1-Carbamoyloxy-3-phenylpropane
- 1-Propanol, 3-phenyl-, carbamate
- 3-Phenyl-1-propanol carbamate
- 3-Phenylpropyl carbamate
- Quamaquil
- NSC 44682
- NSC 50538
- 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).
- 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 | 0.6882 | Relay (1.0) Calculated Property | |
| ΔfG° | -21.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -376.90 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.12 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.95 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.54 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.715 | Crippen Calculated Property | |
| McVol | 145.420 | ml/mol | McGowan Calculated Property |
| Pc | 3287.81 | kPa | Joback Calculated Property |
| Tboil | 549.48 | K | Relay (1.0) Calculated Property |
| Tc | 771.69 | K | Relay (1.0) Calculated Property |
| Tfus | 376.50 ± 0.50 | K | NIST |
| Vc | 0.534 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [357.93; 425.45] | J/mol×K | [603.70; 824.85] | 
|
| Cp,gas | 357.93 | J/mol×K | 603.70 | Joback Calculated Property |
| Cp,gas | 371.21 | J/mol×K | 640.56 | Joback Calculated Property |
| Cp,gas | 383.65 | J/mol×K | 677.42 | Joback Calculated Property |
| Cp,gas | 395.27 | J/mol×K | 714.27 | Joback Calculated Property |
| Cp,gas | 406.09 | J/mol×K | 751.13 | Joback Calculated Property |
| Cp,gas | 416.14 | J/mol×K | 787.99 | Joback Calculated Property |
| Cp,gas | 425.45 | J/mol×K | 824.85 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenprobamate.
Sources
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