- InChI
- InChI=1S/C6H13BrO2/c1-3-8-6(5-7)9-4-2/h6H,3-5H2,1-2H3
- InChI Key
- LILXDMFJXYAKMK-UHFFFAOYSA-N
- Formula
- C6H13BrO2
- SMILES
- CCOC(CBr)OCC
- Molecular Weight1
- 197.07
- CAS
- 2032-35-1
- Other Names
-
- Acetaldehyde, bromo-, diethyl acetal
- Bromacetal
- Bromoacetaldehyde diethyl acetal
- Diethyl bromoacetaldehyde acetal
- 1-Bromo-2,2-diethoxyethane
- 1,1-Diethoxy-2-bromoethane
- 2-Bromoacetaldehyde diethyl acetal
- Bromoacetal
- Diethyl bromoacetal
- 2-Bromo-1,1-diethoxyethane
- 2,2-Diethoxyethyl bromide
- NSC 8036
- 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).
- 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).
- Tboilr : Boiling point at reduced pressure (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 |
|---|---|---|---|
| ΔfG° | -198.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -410.56 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.82 | kJ/mol | Joback Calculated Property |
| log10WS | -1.55 | Crippen Calculated Property | |
| logPoct/wat | 1.780 | Crippen Calculated Property | |
| McVol | 124.640 | ml/mol | McGowan Calculated Property |
| Pc | 3261.58 | kPa | Joback Calculated Property |
| Inp | [1005.00; 1005.00] |
|
|
| Inp | 1005.00 | NIST | |
| Inp | 1005.00 | NIST | |
| Tboil | 447.24 | K | Joback Calculated Property |
| Tc | 634.34 | K | Joback Calculated Property |
| Tfus | 246.64 | K | Joback Calculated Property |
| Vc | 0.464 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [242.32; 300.26] | J/mol×K | [447.24; 634.34] |
|
| Cp,gas | 242.32 | J/mol×K | 447.24 | Joback Calculated Property |
| Cp,gas | 252.85 | J/mol×K | 478.42 | Joback Calculated Property |
| Cp,gas | 263.04 | J/mol×K | 509.61 | Joback Calculated Property |
| Cp,gas | 272.87 | J/mol×K | 540.79 | Joback Calculated Property |
| Cp,gas | 282.36 | J/mol×K | 571.97 | Joback Calculated Property |
| Cp,gas | 291.49 | J/mol×K | 603.16 | Joback Calculated Property |
| Cp,gas | 300.26 | J/mol×K | 634.34 | Joback Calculated Property |
| η | [0.0002360; 0.0032499] | Pa×s | [246.64; 447.24] |
|
| η | 0.0032499 | Pa×s | 246.64 | Joback Calculated Property |
| η | 0.0016171 | Pa×s | 280.07 | Joback Calculated Property |
| η | 0.0009338 | Pa×s | 313.51 | Joback Calculated Property |
| η | 0.0005994 | Pa×s | 346.94 | Joback Calculated Property |
| η | 0.0004160 | Pa×s | 380.37 | Joback Calculated Property |
| η | 0.0003062 | Pa×s | 413.81 | Joback Calculated Property |
| η | 0.0002360 | Pa×s | 447.24 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [339.50; 339.70] | K | [2.40; 2.40] |
|
| Tboilr | 339.50 ± 0.50 | K | 2.40 | NIST |
| Tboilr | 339.70 | K | 2.40 | NIST |
Similar Compounds
Find more compounds similar to Ethane, 2-bromo-1,1-diethoxy-.
Sources
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