- InChI
- InChI=1S/C15H10ClFN2O/c16-9-5-6-13-11(7-9)15(18-8-14(20)19-13)10-3-1-2-4-12(10)17/h1-7H,8H2,(H,19,20)
- InChI Key
- UVCOILFBWYKHHB-UHFFFAOYSA-N
- Formula
- C15H10ClFN2O
- SMILES
-
O=C1CN=C(c2ccccc2F)c2cc(Cl)ccc
2N1 - Molecular Weight1
- 288.70
- CAS
- 2886-65-9
- Other Names
-
- 2H-1,4-Benzodiazepin-2-one, 7-chloro-5-(2-fluorophenyl)-1,3-dihydro-
- 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-5-(2-fluorophenyl)-
- 7-Chloro-5-(2-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one
- Ro 5-3367
- 2H-1,4-Benzodiazepin-2-one, 7-chloro-5-(o-fluorophenyl)-1,3-dihydro-
- N-Desalkylflutoprazepam
- N-Desalkyl-2-oxoquazepam
- Dealkylflurazepam
- Descarbethoxyloflazepate
- N-Desalkylflurazepam
- Flurazepam, des-alkyl
- Flurazepam M (des-alkyl)
- Flurazepam M (N-1-des-alkyl)
- N-1-Desalkyl-flurazepam
- 7-Chloro-5-(o-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one
- Norflutoprazepam
- Sch 17514
- Desalkylflurazepam
- Norfludiazepam - from non-authenticated sample -
- 7-Chloro-1,3-dihydro-5-(2'-fluorophenyl)-2H-1,4-benzodiazapin-2-one (desalkylflurazepam)
- 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).
- ΔfusH : Enthalpy of fusion at a given temperature (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 | 0.6272 | Relay (1.0) Calculated Property | |
| ΔfG° | 211.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -71.09 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 36.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.09 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.10 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.91 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.269 | Crippen Calculated Property | |
| McVol | 195.070 | ml/mol | McGowan Calculated Property |
| Pc | 2992.59 | kPa | Joback Calculated Property |
| Inp | [2430.00; 2475.00] |
|
|
| Inp | 2442.00 | NIST | |
| Inp | 2469.00 | NIST | |
| Inp | 2475.00 | NIST | |
| Inp | 2457.00 | NIST | |
| Inp | 2430.00 | NIST | |
| Inp | 2471.00 | NIST | |
| Inp | 2471.00 | NIST | |
| Inp | 2475.00 | NIST | |
| Inp | 2442.00 | NIST | |
| Inp | 2457.00 | NIST | |
| Tboil | 674.50 | K | Relay (1.0) Calculated Property |
| Tc | 1005.68 | K | Relay (1.0) Calculated Property |
| Tfus | 483.07 | K | Relay (1.0) Calculated Property |
| Vc | 0.682 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [551.72; 604.57] | J/mol×K | [841.76; 1121.83] |
|
| Cp,gas | 551.72 | J/mol×K | 841.76 | Joback Calculated Property |
| Cp,gas | 565.08 | J/mol×K | 888.44 | Joback Calculated Property |
| Cp,gas | 576.63 | J/mol×K | 935.12 | Joback Calculated Property |
| Cp,gas | 586.35 | J/mol×K | 981.80 | Joback Calculated Property |
| Cp,gas | 594.25 | J/mol×K | 1028.47 | Joback Calculated Property |
| Cp,gas | 600.33 | J/mol×K | 1075.15 | Joback Calculated Property |
| Cp,gas | 604.57 | J/mol×K | 1121.83 | Joback Calculated Property |
| ΔfusH | 30.70 | kJ/mol | 481.20 | NIST |
Similar Compounds
Find more compounds similar to Norfludiazepam.
Sources
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