- InChI
- InChI=1S/C24H22/c1(9-19-13-7-15-21-11-3-5-17-23(19)21)2-10-20-14-8-16-22-12-4-6-18-24(20)22/h3-8,11-18H,1-2,9-10H2
- InChI Key
- OISFPCIBPOZHNF-UHFFFAOYSA-N
- Formula
- C24H22
- SMILES
-
c1ccc2c(CCCCc3cccc4ccccc34)ccc
c2c1 - Molecular Weight1
- 310.43
- CAS
- 29571-17-3
- 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).
- 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 | 0.7168 | Relay (1.0) Calculated Property | |
| ΔfG° | 570.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 244.93 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 39.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 132.78 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.67 | eV | NIST |
| log10WS | -8.41 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.558 | Crippen Calculated Property | |
| McVol | 262.580 | ml/mol | McGowan Calculated Property |
| Pc | 1736.11 | kPa | Joback Calculated Property |
| Tboil | 739.34 | K | Relay (1.0) Calculated Property |
| Tc | 1027.35 | K | Relay (1.0) Calculated Property |
| Tfus | 371.31 | K | Relay (1.0) Calculated Property |
| Vc | 0.988 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [323.20; 832.81] | 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 | -1.21026e+02 | |||
| Coefficient B | 1.99960e+00 | |||
| Coefficient C | -1.48356e-03 | |||
| Coefficient D | 4.37800e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 323.20 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 420.09 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 503.68 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 575.36 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 636.51 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 688.52 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 732.77 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 770.65 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 803.53 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 832.81 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0011544; 0.0003059] | Pa×s | [503.52; 768.49] |
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 | -1.06160e+01 | |||
| Coefficient B | 1.93948e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 503.52 | |||
| Temperature range, max. | 768.49 | |||
| η | 0.0011544 | Pa×s | 503.52 | Calculated Property |
| η | 0.0009332 | Pa×s | 532.96 | Calculated Property |
| η | 0.0007713 | Pa×s | 562.40 | Calculated Property |
| η | 0.0006497 | Pa×s | 591.84 | Calculated Property |
| η | 0.0005563 | Pa×s | 621.28 | Calculated Property |
| η | 0.0004830 | Pa×s | 650.73 | Calculated Property |
| η | 0.0004245 | Pa×s | 680.17 | Calculated Property |
| η | 0.0003772 | Pa×s | 709.61 | Calculated Property |
| η | 0.0003383 | Pa×s | 739.05 | Calculated Property |
| η | 0.0003059 | Pa×s | 768.49 | Calculated Property |
Similar Compounds
Find more compounds similar to Naphthalene, 1,1'-(1,4-butanediyl)bis-.
Sources
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