- InChI
- InChI=1S/C15H16O2/c1-11(16)3-4-12-5-6-14-10-15(17-2)8-7-13(14)9-12/h5-10H,3-4H2,1-2H3
- InChI Key
- BLXXJMDCKKHMKV-UHFFFAOYSA-N
- Formula
- C15H16O2
- SMILES
- COc1ccc2cc(CCC(C)=O)ccc2c1
- Molecular Weight1
- 228.29
- CAS
- 42924-53-8
- Other Names
-
- 2-Butanone, 4-(6-methoxy-2-naphthalenyl)-
- 4-(6-Methoxy-2-naphthalenyl)-2-butanone
- 4-(6-Methoxy-2-naphthyl)-2-butanone
- 4-(6-Methoxy-2-naphyl)-2-butanone
- 4-(6-methoxynaphthalen-2-yl)butan-2-one
- Arthaxan
- BRL 147777
- BRL-14777
- Balmox
- Consolan
- Nabumeton
- Nabuser
- Relafen
- Relifen
- Relifex
- 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).
- 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° | 41.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -193.07 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.38 | kJ/mol | Joback Calculated Property |
| log10WS | -1.46 | Aq. Sol... | |
| logPoct/wat | 3.370 | Crippen Calculated Property | |
| McVol | 186.430 | ml/mol | McGowan Calculated Property |
| Pc | 2342.82 | kPa | Joback Calculated Property |
| Inp | 2103.00 | NIST | |
| Tboil | 674.51 | K | Joback Calculated Property |
| Tc | 897.40 | K | Joback Calculated Property |
| Tfus | 415.13 | K | Joback Calculated Property |
| Vc | 0.714 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [484.00; 559.88] | J/mol×K | [674.51; 897.40] | 
|
| Cp,gas | 484.00 | J/mol×K | 674.51 | Joback Calculated Property |
| Cp,gas | 498.93 | J/mol×K | 711.66 | Joback Calculated Property |
| Cp,gas | 512.88 | J/mol×K | 748.81 | Joback Calculated Property |
| Cp,gas | 525.90 | J/mol×K | 785.95 | Joback Calculated Property |
| Cp,gas | 538.04 | J/mol×K | 823.10 | Joback Calculated Property |
| Cp,gas | 549.35 | J/mol×K | 860.25 | Joback Calculated Property |
| Cp,gas | 559.88 | J/mol×K | 897.40 | Joback Calculated Property |
| η | [0.0002362; 0.0011670] | Pa×s | [415.13; 674.51] |
|
| η | 0.0011670 | Pa×s | 415.13 | Joback Calculated Property |
| η | 0.0007887 | Pa×s | 458.36 | Joback Calculated Property |
| η | 0.0005703 | Pa×s | 501.59 | Joback Calculated Property |
| η | 0.0004341 | Pa×s | 544.82 | Joback Calculated Property |
| η | 0.0003440 | Pa×s | 588.05 | Joback Calculated Property |
| η | 0.0002814 | Pa×s | 631.28 | Joback Calculated Property |
| η | 0.0002362 | Pa×s | 674.51 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Nabumetone.
Sources
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