- InChI
- InChI=1S/C17H18O3/c1-17(2,3)12-8-10-13(11-9-12)20-16(19)14-6-4-5-7-15(14)18/h4-11,18H,1-3H3
- InChI Key
- DBOSBRHMHBENLP-UHFFFAOYSA-N
- Formula
- C17H18O3
- SMILES
-
CC(C)(C)c1ccc(OC(=O)c2ccccc2O)
cc1 - Molecular Weight1
- 270.32
- CAS
- 87-18-3
- Other Names
-
- 4-tert-Butylphenyl salicylate
- Salicylic acid p-tert-butylphenyl ester
- Benzoic acid, 2-hydroxy-, 4-(1,1-dimethylethyl)phenyl ester
- Salicyclic acid p-tert-butylphenyl ester
- UV Absorber NL/3
- p-terc.Butylfenylester kyseliny salicylove
- 4-(t-Butylphenyl) salicyclate
- Salicyclic acid, 4-(t-butylphenyl) ester
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- ΔsubH : Enthalpy of sublimation 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).
- 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° | -78.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -363.48 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.52 | kJ/mol | Joback Calculated Property |
| log10WS | -4.42 | Crippen Calculated Property | |
| logPoct/wat | 3.909 | Crippen Calculated Property | |
| McVol | 216.180 | ml/mol | McGowan Calculated Property |
| Pc | 2527.73 | kPa | Joback Calculated Property |
| Tboil | 800.38 | K | Joback Calculated Property |
| Tc | 1048.95 | K | Joback Calculated Property |
| Tfus | 533.01 | K | Joback Calculated Property |
| Vc | 0.750 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [624.93; 700.97] | J/mol×K | [800.38; 1048.95] | 
|
| Cp,gas | 624.93 | J/mol×K | 800.38 | Joback Calculated Property |
| Cp,gas | 639.58 | J/mol×K | 841.81 | Joback Calculated Property |
| Cp,gas | 653.24 | J/mol×K | 883.24 | Joback Calculated Property |
| Cp,gas | 666.05 | J/mol×K | 924.67 | Joback Calculated Property |
| Cp,gas | 678.17 | J/mol×K | 966.09 | Joback Calculated Property |
| Cp,gas | 689.76 | J/mol×K | 1007.52 | Joback Calculated Property |
| Cp,gas | 700.97 | J/mol×K | 1048.95 | Joback Calculated Property |
| η | [0.0000052; 0.0001235] | Pa×s | [533.01; 800.38] |
|
| η | 0.0001235 | Pa×s | 533.01 | Joback Calculated Property |
| η | 0.0000595 | Pa×s | 577.57 | Joback Calculated Property |
| η | 0.0000318 | Pa×s | 622.13 | Joback Calculated Property |
| η | 0.0000185 | Pa×s | 666.69 | Joback Calculated Property |
| η | 0.0000115 | Pa×s | 711.26 | Joback Calculated Property |
| η | 0.0000076 | Pa×s | 755.82 | Joback Calculated Property |
| η | 0.0000052 | Pa×s | 800.38 | Joback Calculated Property |
| ΔsubH | 137.40 | kJ/mol | 314.50 | NIST |
| ΔvapH | 90.40 | kJ/mol | 387.00 | NIST |
Similar Compounds
Find more compounds similar to p-tert-Butylphenylsalicylate.
Sources
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