- InChI
- InChI=1S/C7H7N3O3/c8-9-7(11)5-2-1-3-6(4-5)10(12)13/h1-4H,8H2,(H,9,11)
- InChI Key
- NQEWXLVDAVTOHM-UHFFFAOYSA-N
- Formula
- C7H7N3O3
- SMILES
- NNC(=O)c1cccc([N+](=O)[O-])c1
- Molecular Weight1
- 181.15
- CAS
- 618-94-0
- Other Names
-
- 3-Nitrobenzoic acid hydrazide
- m-Nitrobenzhydrazide
- Benzoic acid, 3-nitro-, hydrazide
- m-Nitrobenzoic acid hydrazide
- m-Nitrobenzoic hydrazide
- m-Nitrobenzoylhydrazide
- m-Nitrobenzoylhydrazine
- Benzoic acid, m-nitro-, hydrazide
- 3-Nitrobenzoylhydrazine
- NSC 123864
- NSC 3558
- 3-nitrobenzohydrazide
- 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).
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 173.31 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 1.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.53 | kJ/mol | Joback Calculated Property |
| log10WS | -2.47 | Crippen Calculated Property | |
| logPoct/wat | 0.198 | Crippen Calculated Property | |
| McVol | 124.680 | ml/mol | McGowan Calculated Property |
| Pc | 4897.06 | kPa | Joback Calculated Property |
| Tboil | 719.63 | K | Joback Calculated Property |
| Tc | 978.77 | K | Joback Calculated Property |
| Tfus | 537.05 | K | Joback Calculated Property |
| Vc | 0.471 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [321.71; 364.62] | J/mol×K | [719.63; 978.77] | 
|
| Cp,gas | 321.71 | J/mol×K | 719.63 | Joback Calculated Property |
| Cp,gas | 330.87 | J/mol×K | 762.82 | Joback Calculated Property |
| Cp,gas | 339.15 | J/mol×K | 806.01 | Joback Calculated Property |
| Cp,gas | 346.62 | J/mol×K | 849.20 | Joback Calculated Property |
| Cp,gas | 353.32 | J/mol×K | 892.39 | Joback Calculated Property |
| Cp,gas | 359.30 | J/mol×K | 935.58 | Joback Calculated Property |
| Cp,gas | 364.62 | J/mol×K | 978.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Nitrobenzhydrazide.
Sources
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