- InChI
- InChI=1S/C12H11Cl/c1-9-6-7-10-4-2-3-5-11(10)12(9)8-13/h2-7H,8H2,1H3
- InChI Key
- STBYRSZXHDPASK-UHFFFAOYSA-N
- Formula
- C12H11Cl
- SMILES
- Cc1ccc2ccccc2c1CCl
- Molecular Weight1
- 190.67
- Other Names
-
- 1-Chloromethyl-2-methylnaphthalene
- 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 | 0.4463 | Relay (1.0) Calculated Property | |
| ΔfG° | 238.03 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 55.58 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 21.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.09 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.26 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.67 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.887 | Crippen Calculated Property | |
| McVol | 148.960 | ml/mol | McGowan Calculated Property |
| Pc | 2887.40 | kPa | Joback Calculated Property |
| Tboil | 581.68 | K | Relay (1.0) Calculated Property |
| Tc | 829.74 | K | Relay (1.0) Calculated Property |
| Tfus | 311.50 | K | Relay (1.0) Calculated Property |
| Vc | 0.536 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [180.30; 431.30] | 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 | -3.18790e+01 | |||
| Coefficient B | 9.49020e-01 | |||
| Coefficient C | -6.83240e-04 | |||
| Coefficient D | 1.97400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 180.30 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 227.09 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 267.70 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 302.75 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 332.87 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 358.68 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 380.80 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 399.86 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 416.49 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 431.30 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0013939; 0.0003246] | Pa×s | [339.08; 562.24] |
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 | -1.02474e+01 | |||
| Coefficient B | 1.24502e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 339.08 | |||
| Temperature range, max. | 562.24 | |||
| η | 0.0013939 | Pa×s | 339.08 | Calculated Property |
| η | 0.0010853 | Pa×s | 363.88 | Calculated Property |
| η | 0.0008725 | Pa×s | 388.67 | Calculated Property |
| η | 0.0007200 | Pa×s | 413.47 | Calculated Property |
| η | 0.0006072 | Pa×s | 438.26 | Calculated Property |
| η | 0.0005215 | Pa×s | 463.06 | Calculated Property |
| η | 0.0004549 | Pa×s | 487.86 | Calculated Property |
| η | 0.0004021 | Pa×s | 512.65 | Calculated Property |
| η | 0.0003595 | Pa×s | 537.45 | Calculated Property |
| η | 0.0003246 | Pa×s | 562.24 | Calculated Property |
Similar Compounds
Find more compounds similar to Naphthalene, 1-(chloromethyl)-2-methyl-.
Sources
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