- InChI
- InChI=1S/C12H11N3/c1-3-7-11(8-4-1)13-15-14-12-9-5-2-6-10-12/h1-10H,(H,13,14)
- InChI Key
- ALIFPGGMJDWMJH-UHFFFAOYSA-N
- Formula
- C12H11N3
- SMILES
- c1ccc(N=NNc2ccccc2)cc1
- Molecular Weight1
- 197.24
- CAS
- 136-35-6
- Other Names
-
- 1,3-DIPHENYLTRIAZENE
- 1,3-Diphenyltriazine
- Aniline, N-(phenylazo)-
- Cellofor
- DAAB
- DIAZOAMINOBENZENE
- Diazoaminobenzen
- Diazoaminobenzol
- N-(PHENYLAZO)ANILINE
- NSC 2077
- Triazene, 1,3-diphenyl-
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- 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).
- Pvap : Vapor 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 | 0.6348 | Relay (1.0) Calculated Property | |
| ΔcH°solid | [-6705.30; -6562.60] | kJ/mol |
|
| ΔcH°solid | -6562.60 | kJ/mol | NIST |
| ΔcH°solid | -6631.20 | kJ/mol | NIST |
| ΔcH°solid | -6625.80 ± 1.30 | kJ/mol | NIST |
| ΔcH°solid | -6705.30 | kJ/mol | NIST |
| ΔfG° | 480.54 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 455.26 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfH°solid | [331.60; 411.00] | kJ/mol |
|
| ΔfH°solid | 331.60 ± 1.40 | kJ/mol | NIST |
| ΔfH°solid | 411.00 | kJ/mol | NIST |
| ΔvapH° | 81.44 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.77 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.21 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.797 | Crippen Calculated Property | |
| McVol | 158.060 | ml/mol | McGowan Calculated Property |
| Pc | 2611.07 | kPa | Joback Calculated Property |
| Tboil | 601.83 | K | Relay (1.0) Calculated Property |
| Tc | 905.12 | K | Relay (1.0) Calculated Property |
| Tfus | 369.03 | K | Relay (1.0) Calculated Property |
| Vc | 0.592 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [461.60; 629.33] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.61396e+01 | |||
| Coefficient B | -5.73085e+03 | |||
| Coefficient C | -1.00078e+02 | |||
| Temperature range, min. | 461.60 | |||
| Temperature range, max. | 629.33 | |||
| Pvap | 1.33 | kPa | 461.60 | Calculated Property |
| Pvap | 2.90 | kPa | 480.24 | Calculated Property |
| Pvap | 5.87 | kPa | 498.87 | Calculated Property |
| Pvap | 11.14 | kPa | 517.51 | Calculated Property |
| Pvap | 20.04 | kPa | 536.15 | Calculated Property |
| Pvap | 34.33 | kPa | 554.78 | Calculated Property |
| Pvap | 56.40 | kPa | 573.42 | Calculated Property |
| Pvap | 89.21 | kPa | 592.06 | Calculated Property |
| Pvap | 136.48 | kPa | 610.69 | Calculated Property |
| Pvap | 202.63 | kPa | 629.33 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-Triazene, 1,3-diphenyl-.
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
- Joback Method
- KDB
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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