- InChI
- InChI=1S/C14H15NO/c1-10(16)15-13-8-4-2-6-11(13)12-7-3-5-9-14(12)15/h2,4,6,8H,3,5,7,9H2,1H3
- InChI Key
- NAKAGIJKYRVETG-UHFFFAOYSA-N
- Formula
- C14H15NO
- SMILES
- CC(=O)n1c2c(c3ccccc31)CCCC2
- Molecular Weight1
- 213.28
- CAS
- 27236-49-3
- Other Names
-
- 9-Acetyl-2,3,4,9-tetrahydro-1H-carbazole
- 9H-Carbazole, 9-acetyl-1,2,3,4-tetrahydro-
- N-Acetyl-tetrahydrocarbazole
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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.
- I : 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 | 0.5993 | Relay (1.0) Calculated Property | |
| ΔfG° | 153.72 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -105.38 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 88.65 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.12 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.59 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.180 | Crippen Calculated Property | |
| McVol | 169.890 | ml/mol | McGowan Calculated Property |
| Pc | 2542.47 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [2031.00; 2031.00] |
|
|
| Inp | 2031.00 | NIST | |
| Inp | 2031.00 | NIST | |
| I | 3078.00 | NIST | |
| Tboil | 634.12 | K | Relay (1.0) Calculated Property |
| Tc | 908.75 | K | Relay (1.0) Calculated Property |
| Tfus | 394.21 | K | Relay (1.0) Calculated Property |
| Vc | 0.632 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Carbazole, tetrahydro-9-acetyl-.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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