- InChI
- InChI=1S/C8H7F3N2O/c9-8(10,11)6-3-1-5(2-4-6)7(14)13-12/h1-4H,12H2,(H,13,14)
- InChI Key
- GKBDXTNCBPZMFX-UHFFFAOYSA-N
- Formula
- C8H7F3N2O
- SMILES
- NNC(=O)c1ccc(C(F)(F)F)cc1
- Molecular Weight1
- 204.15
- CAS
- 339-59-3
- Other Names
-
- 4-Trifluoromethylbenzoic acid hydrazide
- Benzoic acid, 4-(trifluoromethyl)-, hydrazide
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -435.41 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -605.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.42 | kJ/mol | Joback Calculated Property |
| log10WS | -2.93 | Crippen Calculated Property | |
| logPoct/wat | 1.309 | Crippen Calculated Property | |
| McVol | 126.660 | ml/mol | McGowan Calculated Property |
| Pc | 3659.77 | kPa | Joback Calculated Property |
| Tboil | 585.25 | K | Joback Calculated Property |
| Tc | 798.31 | K | Joback Calculated Property |
| Tfus | 408.90 | K | Joback Calculated Property |
| Vc | 0.488 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [315.04; 365.90] | J/mol×K | [585.25; 798.31] | 
|
| Cp,gas | 315.04 | J/mol×K | 585.25 | Joback Calculated Property |
| Cp,gas | 325.39 | J/mol×K | 620.76 | Joback Calculated Property |
| Cp,gas | 334.93 | J/mol×K | 656.27 | Joback Calculated Property |
| Cp,gas | 343.70 | J/mol×K | 691.78 | Joback Calculated Property |
| Cp,gas | 351.75 | J/mol×K | 727.29 | Joback Calculated Property |
| Cp,gas | 359.13 | J/mol×K | 762.80 | Joback Calculated Property |
| Cp,gas | 365.90 | J/mol×K | 798.31 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Trifluoromethylbenzhydrazide.
Sources
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