- InChI
- InChI=1S/C16H20/c1-9-7-15-13(5)11(3)12(4)14(6)16(15)8-10(9)2/h7-8H,1-6H3
- InChI Key
- BLWBJUXFWPSYLG-UHFFFAOYSA-N
- Formula
- C16H20
- SMILES
- Cc1cc2c(C)c(C)c(C)c(C)c2cc1C
- Molecular Weight1
- 212.34
- ω : Acentric Factor.
- 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).
- 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).
- Inp : Non-polar retention indices.
- 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 | 0.5495 | Relay (1.0) Calculated Property | |
| ΔfG° | 245.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2.68 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.89 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.27 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.41 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.690 | Crippen Calculated Property | |
| McVol | 193.080 | ml/mol | McGowan Calculated Property |
| Pc | 1944.08 | kPa | Joback Calculated Property |
| Inp | 1986.00 | NIST | |
| Tboil | 600.39 | K | Relay (1.0) Calculated Property |
| Tc | 836.93 | K | Relay (1.0) Calculated Property |
| Tfus | 441.65 | K | Relay (1.0) Calculated Property |
| Vc | 0.725 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [261.95; 617.23] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 8.79000e+00 | |||
| Coefficient B | 1.08432e+00 | |||
| Coefficient C | -6.12280e-04 | |||
| Coefficient D | 1.36400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 261.95 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 321.81 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 375.56 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 423.64 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 466.49 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 504.52 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 538.18 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 567.90 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 594.11 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 617.23 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0007572; 0.0002753] | Pa×s | [404.32; 602.11] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.02658e+01 | |||
| Coefficient B | 1.24530e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 404.32 | |||
| Temperature range, max. | 602.11 | |||
| η | 0.0007572 | Pa×s | 404.32 | Calculated Property |
| η | 0.0006461 | Pa×s | 426.30 | Calculated Property |
| η | 0.0005598 | Pa×s | 448.27 | Calculated Property |
| η | 0.0004917 | Pa×s | 470.25 | Calculated Property |
| η | 0.0004369 | Pa×s | 492.23 | Calculated Property |
| η | 0.0003921 | Pa×s | 514.21 | Calculated Property |
| η | 0.0003550 | Pa×s | 536.18 | Calculated Property |
| η | 0.0003240 | Pa×s | 558.16 | Calculated Property |
| η | 0.0002977 | Pa×s | 580.14 | Calculated Property |
| η | 0.0002753 | Pa×s | 602.11 | Calculated Property |
Similar Compounds
Find more compounds similar to Naphthalene, 1,2,3,4,6,7-hexamethyl.
Sources
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