- InChI
- InChI=1S/C5H12O2/c1-7-5-3-2-4-6/h6H,2-5H2,1H3
- InChI Key
- KOVAQMSVARJMPH-UHFFFAOYSA-N
- Formula
- C5H12O2
- SMILES
- COCCCCO
- Molecular Weight1
- 104.15
- Other Names
-
- 1,3-Butylene glycol methyl ether
- 4-Methoxy-1-butanol
- 4-Methoxybutanol
- 4-Methoxybutanol-1
- 4-Methoxybutyl alcohol
- 4-methoxybutan-1-ol
- Butylene glycol methyl ether
- Butylene glycol monomethyl ether
- Dowanol BMAT
- Dowanol bm
- NSC 245191
- 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 | 0.6361 | Relay (1.0) Calculated Property | |
| ΔfG° | -250.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -429.25 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.72 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.44 | Relay (1.0) Calculated Property | |
| logPoct/wat | -0.588 | NCMS SOLV-DB | |
| McVol | 93.050 | ml/mol | McGowan Calculated Property |
| Pc | 3796.32 | kPa | Joback Calculated Property |
| Inp | [886.00; 886.00] |
|
|
| Inp | 886.00 | NIST | |
| Inp | 886.00 | NIST | |
| Tboil | 443.44 | K | Relay (1.0) Calculated Property |
| Tc | 631.94 | K | Relay (1.0) Calculated Property |
| Tfus | 227.58 | K | Relay (1.0) Calculated Property |
| Vc | 0.342 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [139.46; 314.45] | 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 | 2.91340e+01 | |||
| Coefficient B | 4.49620e-01 | |||
| Coefficient C | -1.67600e-04 | |||
| Coefficient D | 3.30000e-09 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 139.46 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 167.37 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 193.14 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 216.78 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 238.30 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 257.71 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 275.02 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 290.24 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 303.38 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 314.45 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0464966; 0.0002830] | Pa×s | [229.16; 413.44] |
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 | -1.45142e+01 | |||
| Coefficient B | 2.62292e+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. | 229.16 | |||
| Temperature range, max. | 413.44 | |||
| η | 0.0464966 | Pa×s | 229.16 | Calculated Property |
| η | 0.0181844 | Pa×s | 249.64 | Calculated Property |
| η | 0.0081995 | Pa×s | 270.11 | Calculated Property |
| η | 0.0041365 | Pa×s | 290.59 | Calculated Property |
| η | 0.0022834 | Pa×s | 311.06 | Calculated Property |
| η | 0.0013565 | Pa×s | 331.54 | Calculated Property |
| η | 0.0008562 | Pa×s | 352.02 | Calculated Property |
| η | 0.0005684 | Pa×s | 372.49 | Calculated Property |
| η | 0.0003939 | Pa×s | 392.97 | Calculated Property |
| η | 0.0002830 | Pa×s | 413.44 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-Butanol, 4-methoxy-.
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