- InChI
- InChI=1S/C8H9NO2/c1-11-8(10)9-7-5-3-2-4-6-7/h2-6H,1H3,(H,9,10)
- InChI Key
- IAGUPODHENSJEZ-UHFFFAOYSA-N
- Formula
- C8H9NO2
- SMILES
- COC(=O)Nc1ccccc1
- Molecular Weight1
- 151.16
- CAS
- 2603-10-3
- Other Names
-
- Carbanilic acid, methyl ester
- Methyl N-phenylurethane
- Methyl carbanilate
- Methyl phenylurethane
- N-Phenylcarbamic acid methyl ester
- methyl N-phenylcarbamate
- methyl phenylcarbamate
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,solid : Solid 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 standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (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).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- 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 |
|---|---|---|---|
| ΔcH°solid | -4248.00 ± 2.00 | kJ/mol | NIST |
| ΔfG° | -15.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -163.25 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.27 | kJ/mol | Joback Calculated Property |
| log10WS | -1.74 | Crippen Calculated Property | |
| logPoct/wat | 1.865 | Crippen Calculated Property | |
| McVol | 117.240 | ml/mol | McGowan Calculated Property |
| Pc | 3925.85 | kPa | Joback Calculated Property |
| Inp | [1313.00; 1340.00] |
|
|
| Inp | 1315.00 | NIST | |
| Inp | 1320.00 | NIST | |
| Inp | 1317.00 | NIST | |
| Inp | 1336.00 | NIST | |
| Inp | 1313.00 | NIST | |
| Inp | 1330.00 | NIST | |
| Inp | 1340.00 | NIST | |
| I | [1995.00; 1995.00] |
|
|
| I | 1995.00 | NIST | |
| I | 1995.00 | NIST | |
| Tboil | 535.58 | K | Joback Calculated Property |
| Tc | 755.73 | K | Joback Calculated Property |
| Tfus | 325.00 ± 1.00 | K | NIST |
| Vc | 0.434 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [257.09; 317.41] | J/mol×K | [535.58; 755.73] |
|
| Cp,gas | 257.09 | J/mol×K | 535.58 | Joback Calculated Property |
| Cp,gas | 268.87 | J/mol×K | 572.27 | Joback Calculated Property |
| Cp,gas | 279.94 | J/mol×K | 608.96 | Joback Calculated Property |
| Cp,gas | 290.31 | J/mol×K | 645.65 | Joback Calculated Property |
| Cp,gas | 300.01 | J/mol×K | 682.34 | Joback Calculated Property |
| Cp,gas | 309.03 | J/mol×K | 719.03 | Joback Calculated Property |
| Cp,gas | 317.41 | J/mol×K | 755.73 | Joback Calculated Property |
| Cp,solid | 203.30 | J/mol×K | 298.00 | NIST |
| ΔfusH | [14.55; 14.56] | kJ/mol | [325.00; 325.00] |
|
| ΔfusH | 14.55 | kJ/mol | 325.00 | NIST |
| ΔfusH | 14.56 | kJ/mol | 325.00 | NIST |
| ΔfusH | 14.56 | kJ/mol | 325.00 | NIST |
| Pvap | [0.21; 2.13] | kPa | [372.50; 418.45] |
|
| Pvap | 0.21 | kPa | 372.50 | Determi... |
| Pvap | 0.22 | kPa | 374.46 | Determi... |
| Pvap | 0.25 | kPa | 376.90 | Determi... |
| Pvap | 0.31 | kPa | 379.05 | Determi... |
| Pvap | 0.33 | kPa | 380.65 | Determi... |
| Pvap | 0.39 | kPa | 383.31 | Determi... |
| Pvap | 0.45 | kPa | 385.85 | Determi... |
| Pvap | 0.50 | kPa | 387.85 | Determi... |
| Pvap | 0.56 | kPa | 390.35 | Determi... |
| Pvap | 0.59 | kPa | 391.76 | Determi... |
| Pvap | 0.65 | kPa | 394.05 | Determi... |
| Pvap | 0.72 | kPa | 395.80 | Determi... |
| Pvap | 0.79 | kPa | 397.05 | Determi... |
| Pvap | 0.79 | kPa | 397.05 | Determi... |
| Pvap | 0.94 | kPa | 399.63 | Determi... |
| Pvap | 0.94 | kPa | 399.83 | Determi... |
| Pvap | 1.06 | kPa | 402.15 | Determi... |
| Pvap | 1.29 | kPa | 409.85 | Determi... |
| Pvap | 1.54 | kPa | 412.90 | Determi... |
| Pvap | 1.97 | kPa | 415.90 | Determi... |
| Pvap | 2.13 | kPa | 418.45 | Determi... |
| ΔfusS | 44.80 | J/mol×K | 325.00 | NIST |
Similar Compounds
Find more compounds similar to Carbamic acid, phenyl-, methyl ester.
Mixtures
Sources
- Crippen Method
- Crippen Method
- Determination and Modeling of Isobaric Vapor Liquid Equilibria for the Methylcarbamate + Methyl-N-phenyl Carbamate System at Different Pressures
- Joback Method
- McGowan Method
- NIST Webbook
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