- InChI
- InChI=1S/C7H13Br/c8-7-5-3-1-2-4-6-7/h7H,1-6H2
- InChI Key
- LOXORFRCPXUORP-UHFFFAOYSA-N
- Formula
- C7H13Br
- SMILES
- BrC1CCCCCC1
- Molecular Weight1
- 177.08
- CAS
- 2404-35-5
- Other Names
-
- Bromocycloheptane
- Cycloheptyl bromide
- 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° | 34.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -113.32 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 8.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 38.21 | kJ/mol | Joback Calculated Property |
| log10WS | -3.19 | Crippen Calculated Property | |
| logPoct/wat | 3.104 | Crippen Calculated Property | |
| McVol | 116.130 | ml/mol | McGowan Calculated Property |
| Pc | 3950.57 | kPa | Joback Calculated Property |
| Inp | [1157.00; 1157.00] |
|
|
| Inp | 1157.00 | NIST | |
| Inp | 1157.00 | NIST | |
| Tboil | 449.54 | K | Joback Calculated Property |
| Tc | 681.95 | K | Joback Calculated Property |
| Tfus | 232.31 | K | Joback Calculated Property |
| Vc | 0.414 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [216.63; 304.77] | J/mol×K | [449.54; 681.95] |
|
| Cp,gas | 216.63 | J/mol×K | 449.54 | Joback Calculated Property |
| Cp,gas | 233.75 | J/mol×K | 488.28 | Joback Calculated Property |
| Cp,gas | 249.85 | J/mol×K | 527.01 | Joback Calculated Property |
| Cp,gas | 264.98 | J/mol×K | 565.75 | Joback Calculated Property |
| Cp,gas | 279.16 | J/mol×K | 604.48 | Joback Calculated Property |
| Cp,gas | 292.41 | J/mol×K | 643.22 | Joback Calculated Property |
| Cp,gas | 304.77 | J/mol×K | 681.95 | Joback Calculated Property |
| η | [0.0003162; 0.0086730] | Pa×s | [232.31; 449.54] |
|
| η | 0.0086730 | Pa×s | 232.31 | Joback Calculated Property |
| η | 0.0034426 | Pa×s | 268.51 | Joback Calculated Property |
| η | 0.0017020 | Pa×s | 304.72 | Joback Calculated Property |
| η | 0.0009772 | Pa×s | 340.92 | Joback Calculated Property |
| η | 0.0006242 | Pa×s | 377.13 | Joback Calculated Property |
| η | 0.0004313 | Pa×s | 413.33 | Joback Calculated Property |
| η | 0.0003162 | Pa×s | 449.54 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [344.70; 356.00] | K | [1.30; 2.00] |
|
| Tboilr | 344.70 | K | 1.30 | NIST |
| Tboilr | 356.00 | K | 2.00 | NIST |
Similar Compounds
Find more compounds similar to Cycloheptane, bromo-.
Sources
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