- InChI
- InChI=1S/C17H18/c1-2-6-14(7-3-1)12-15-10-11-16-8-4-5-9-17(16)13-15/h1-9,15H,10-13H2
- InChI Key
- AKGFRVNFTJTZLR-UHFFFAOYSA-N
- Formula
- C17H18
- SMILES
- c1ccc(CC2CCc3ccccc3C2)cc1
- Molecular Weight1
- 222.33
- Other Names
-
- 2-(phenylmethyl)-1,2,3,4-tetrahydronaphthalene
- Naphthalene, 2-benzyl-1,2,3,4-tetrahydro-
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- 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.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfusH° | 23.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.75 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.23 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 4.034 | Crippen Calculated Property | |
| McVol | 192.010 | ml/mol | McGowan Calculated Property |
| Pc | 2384.19 | kPa | Joback Calculated Property |
| Tboil | 612.16 | K | Relay (1.0) Calculated Property |
| Tc | 851.01 | K | Relay (1.0) Calculated Property |
| Tfus | 285.12 | K | Relay (1.0) Calculated Property |
| Vc | 0.710 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [511.89; 611.82] | J/mol×K | [657.71; 908.48] | 
|
| Cp,gas | 511.89 | J/mol×K | 657.71 | Joback Calculated Property |
| Cp,gas | 532.22 | J/mol×K | 699.51 | Joback Calculated Property |
| Cp,gas | 550.91 | J/mol×K | 741.30 | Joback Calculated Property |
| Cp,gas | 568.09 | J/mol×K | 783.10 | Joback Calculated Property |
| Cp,gas | 583.88 | J/mol×K | 824.89 | Joback Calculated Property |
| Cp,gas | 598.42 | J/mol×K | 866.69 | Joback Calculated Property |
| Cp,gas | 611.82 | J/mol×K | 908.48 | Joback Calculated Property |
| η | [0.0002607; 0.0019811] | Pa×s | [361.13; 657.71] |
|
| η | 0.0019811 | Pa×s | 361.13 | Joback Calculated Property |
| η | 0.0011528 | Pa×s | 410.56 | Joback Calculated Property |
| η | 0.0007535 | Pa×s | 459.99 | Joback Calculated Property |
| η | 0.0005349 | Pa×s | 509.42 | Joback Calculated Property |
| η | 0.0004035 | Pa×s | 558.85 | Joback Calculated Property |
| η | 0.0003186 | Pa×s | 608.28 | Joback Calculated Property |
| η | 0.0002607 | Pa×s | 657.71 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Naphthalene, 1,2,3,4-tetrahydro-2-(phenylmethyl)-.
Sources
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