- InChI
- InChI=1S/C10H7Br/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H
- InChI Key
- APSMUYYLXZULMS-UHFFFAOYSA-N
- Formula
- C10H7Br
- SMILES
- Brc1ccc2ccccc2c1
- Molecular Weight1
- 207.07
- CAS
- 580-13-2
- Other Names
-
- 2-Bromonaphthalene
- 2-Bromonapthalene
- 2-Naphthyl bromide
- «beta»-Bromonaphthalene
- «beta»-Naphthyl bromide
- «beta»-Bromonaphthalene
- «beta»-Naphthyl bromide
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔsubH° : Enthalpy of sublimation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- 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 |
|---|---|---|---|
| ΔcH°solid | -5029.90 ± 1.70 | kJ/mol | NIST |
| ΔfG° | 257.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 175.60 ± 2.30 | kJ/mol | NIST |
| ΔfH°solid | 94.40 ± 2.10 | kJ/mol | NIST |
| ΔfusH° | 17.61 | kJ/mol | Joback Calculated Property |
| ΔsubH° | [64.00; 81.20] | kJ/mol |
|
| ΔsubH° | 81.20 ± 1.00 | kJ/mol | NIST |
| ΔsubH° | 81.20 ± 1.00 | kJ/mol | NIST |
| ΔsubH° | 64.00 ± 5.00 | kJ/mol | NIST |
| ΔvapH° | 66.10 ± 0.40 | kJ/mol | NIST |
| IE | 8.18 ± 0.03 | eV | NIST |
| log10WS | [-4.40; -4.40] |
|
|
| log10WS | -4.40 | Aq. Sol... | |
| log10WS | -4.40 | Estimat... | |
| logPoct/wat | 3.602 | Crippen Calculated Property | |
| McVol | 126.040 | ml/mol | McGowan Calculated Property |
| Pc | 4173.09 | kPa | Joback Calculated Property |
| Tboil | [554.15; 554.70] | K |
|
| Tboil | 554.70 | K | NIST |
| Tboil | 554.15 ± 0.70 | K | NIST |
| Tc | 800.62 | K | Joback Calculated Property |
| Tfus | 332.00 ± 1.00 | K | NIST |
| Vc | 0.471 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [244.65; 302.26] | J/mol×K | [545.00; 800.62] |
|
| Cp,gas | 244.65 | J/mol×K | 545.00 | Joback Calculated Property |
| Cp,gas | 256.61 | J/mol×K | 587.60 | Joback Calculated Property |
| Cp,gas | 267.49 | J/mol×K | 630.21 | Joback Calculated Property |
| Cp,gas | 277.39 | J/mol×K | 672.81 | Joback Calculated Property |
| Cp,gas | 286.42 | J/mol×K | 715.42 | Joback Calculated Property |
| Cp,gas | 294.68 | J/mol×K | 758.02 | Joback Calculated Property |
| Cp,gas | 302.26 | J/mol×K | 800.62 | Joback Calculated Property |
| η | [0.0003922; 0.0016175] | Pa×s | [333.90; 545.00] |
|
| η | 0.0016175 | Pa×s | 333.90 | Joback Calculated Property |
| η | 0.0011413 | Pa×s | 369.08 | Joback Calculated Property |
| η | 0.0008557 | Pa×s | 404.27 | Joback Calculated Property |
| η | 0.0006718 | Pa×s | 439.45 | Joback Calculated Property |
| η | 0.0005467 | Pa×s | 474.63 | Joback Calculated Property |
| η | 0.0004578 | Pa×s | 509.82 | Joback Calculated Property |
| η | 0.0003922 | Pa×s | 545.00 | Joback Calculated Property |
| ΔfusH | [5.77; 14.40] | kJ/mol | [319.00; 329.00] |
|
| ΔfusH | 5.77 | kJ/mol | 319.00 | NIST |
| ΔfusH | 14.40 | kJ/mol | 329.00 | NIST |
| ΔfusH | 14.40 | kJ/mol | 329.00 | NIST |
| ΔvapH | [40.40; 42.50] | kJ/mol | [340.50; 354.00] |
|
| ΔvapH | 40.40 | kJ/mol | 340.50 | NIST |
| ΔvapH | 42.50 | kJ/mol | 354.00 | NIST |
| ΔfusS | [18.09; 43.76] | J/mol×K | [319.00; 329.00] |
|
| ΔfusS | 18.09 | J/mol×K | 319.00 | NIST |
| ΔfusS | 43.76 | J/mol×K | 329.00 | NIST |
Similar Compounds
Find more compounds similar to Naphthalene, 2-bromo-.
Sources
- Crippen Method
- Joback Method
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
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