![1H-Benzo[cd]fluoranthene](/cid/78-317-4/1H-Benzo-cd-fluoranthene.png "1H-Benzo[cd]fluoranthene")
- InChI
- InChI=1S/C19H12/c1-2-7-15-14(6-1)16-10-8-12-4-3-5-13-9-11-17(15)19(16)18(12)13/h1-4,6-11H,5H2
- InChI Key
- ADWLGGYNRSSUMV-UHFFFAOYSA-N
- Formula
- C19H12
- SMILES
-
C1=Cc2ccc3c4c(ccc(c24)C1)-c1cc
ccc1-3 - Molecular Weight1
- 240.31
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- 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 | 0.5471 | Relay (1.0) Calculated Property | |
| ΔfH°gas | 383.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 29.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.29 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.55 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 5.056 | Crippen Calculated Property | |
| McVol | 185.570 | ml/mol | McGowan Calculated Property |
| Pc | 2704.22 | kPa | Joback Calculated Property |
| Tboil | 711.75 | K | Relay (1.0) Calculated Property |
| Tc | 1007.81 | K | Relay (1.0) Calculated Property |
| Tfus | 371.69 | K | Relay (1.0) Calculated Property |
| Vc | 0.743 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Standard Gibbs free energy of formation, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [492.15; 566.10] | J/mol×K | [740.73; 1000.21] | 
|
| Cp,gas | 492.15 | J/mol×K | 740.73 | Joback Calculated Property |
| Cp,gas | 505.49 | J/mol×K | 783.98 | Joback Calculated Property |
| Cp,gas | 518.05 | J/mol×K | 827.22 | Joback Calculated Property |
| Cp,gas | 530.12 | J/mol×K | 870.47 | Joback Calculated Property |
| Cp,gas | 541.97 | J/mol×K | 913.72 | Joback Calculated Property |
| Cp,gas | 553.87 | J/mol×K | 956.96 | Joback Calculated Property |
| Cp,gas | 566.10 | J/mol×K | 1000.21 | Joback Calculated Property |
| η | [0.0030804; 0.0038035] | Pa×s | [507.71; 740.73] |
|
| η | 0.0038035 | Pa×s | 507.71 | Joback Calculated Property |
| η | 0.0036266 | Pa×s | 546.55 | Joback Calculated Property |
| η | 0.0034798 | Pa×s | 585.38 | Joback Calculated Property |
| η | 0.0033562 | Pa×s | 624.22 | Joback Calculated Property |
| η | 0.0032507 | Pa×s | 663.06 | Joback Calculated Property |
| η | 0.0031597 | Pa×s | 701.89 | Joback Calculated Property |
| η | 0.0030804 | Pa×s | 740.73 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1H-Benzo[cd]fluoranthene.
Sources
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