- InChI
- InChI=1S/C14H18N2O4/c1-8-10(15(17)18)6-9-11(12(8)16(19)20)14(4,5)7-13(9,2)3/h6H,7H2,1-5H3
- InChI Key
- UHWURQRPEIFIAK-UHFFFAOYSA-N
- Formula
- C14H18N2O4
- SMILES
-
Cc1c([N+](=O)[O-])cc2c(c1[N+](
=O)[O-])C(C)(C)CC2(C)C - Molecular Weight1
- 278.30
- CAS
- 116-66-5
- Other Names
-
- 1H-Indene, 2,3-dihydro-1,1,3,3,5-pentamethyl-4,6-dinitro-
- Indan, 1,1,3,3,5-pentamethyl-4,6-dinitro-
- Moskene
- 1,1,3,3,5-Pentamethyl-4,6-dinitroindan
- 1,1,3,3,5-Pentamethyl-4,6-dinitrolindan
- Indan, 4,6-dinitro-1,1,3,3,5-pentamethyl-
- 1,1,3,3,5-Pentamethyl-4,6-dinitroindane
- Musk moskene
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 | 0.7198 | Relay (... Calculated Property | |
| ΔfG° | 254.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -63.06 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 33.83 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.24 | kJ/mol | Relay (... Calculated Property |
| IE | 8.95 | eV | Relay (... Calculated Property |
| log10WS | -5.20 | Relay (... Calculated Property | |
| logPoct/wat | 3.770 | Crippen Calculated Property | |
| McVol | 208.340 | ml/mol | McGowan Calculated Property |
| Pc | 2311.39 | kPa | Joback Calculated Property |
| Inp | [1870.60; 1870.60] |
|
|
| Inp | 1870.60 | NIST | |
| Inp | 1870.60 | NIST | |
| Tboil | 576.62 | K | Relay (... Calculated Property |
| Tc | 902.39 | K | Relay (... Calculated Property |
| Tfus | 399.90 | K | Relay (... Calculated Property |
| Vc | 0.747 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [645.20; 787.59] | J/mol×K | [872.55; 1139.84] |
|
| Cp,gas | 645.20 | J/mol×K | 872.55 | Joback Calculated Property |
| Cp,gas | 664.76 | J/mol×K | 917.10 | Joback Calculated Property |
| Cp,gas | 685.42 | J/mol×K | 961.65 | Joback Calculated Property |
| Cp,gas | 707.62 | J/mol×K | 1006.19 | Joback Calculated Property |
| Cp,gas | 731.77 | J/mol×K | 1050.74 | Joback Calculated Property |
| Cp,gas | 758.29 | J/mol×K | 1095.29 | Joback Calculated Property |
| Cp,gas | 787.59 | J/mol×K | 1139.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4,6-Dinitro-1,1,3,3,5-pentamethylindane.
Sources
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