Back to Search
Molecule
M-Aminobenzhydrazide
CAS: 14062-34-1 · C7H9N3O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 14062-34-1
- Molecular Formula
- C7H9N3O
- Molecular Mass
- 151.17 g/mol
Identifiers
CAS Registry Number
14062-34-1
SMILES
NN=C(O)c1cccc(N)c1
InChI Key
JSIVTKBYJLGBPY-UHFFFAOYSA-N
InChI
InChI=1S/C7H9N3O/c8-6-3-1-2-5(4-6)7(11)10-9/h1-4H,8-9H2,(H,10,11)
Names and Synonyms
- M-Aminobenzhydrazide Synonym
- Benzoic acid, 3-amino-, hydrazide Synonym
- Benzoic acid, m-amino-, hydrazide Synonym
- m-Aminobenzhydrazide Synonym
- m-Aminobenzoic hydrazide Synonym
- m-Aminobenzoic acid hydrazide Synonym
- 3-Aminobenzoic acid hydrazide Synonym
- 3-Aminobenzohydrazide Synonym
- 3-Aminobenzhydrazide Synonym
- NSC 28878 Synonym
- 3-Aminobenzoylhydrazide Synonym
- INHd 23 Synonym
- m-Aminobenzohydrazide Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 151.17 g/mol | CAS Common Chemistry |
| 151.16899999999995 g/mol | RDKit | |
| 151.169 g/mol | RDKit | |
| Canonical SMILES | O=C(NN)C=1C=CC=C(N)C1 | CAS Common Chemistry |
| InChI | InChI=1S/C7H9N3O/c8-6-3-1-2-5(4-6)7(11)10-9/h1-4H,8-9H2,(H,10,11) | CAS Common Chemistry |
| InChI Key | InChIKey=JSIVTKBYJLGBPY-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 78 °C | CAS Common Chemistry |
| Name | m-Aminobenzhydrazide | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 3 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 84.63 Ų | RDKit |
| LogP | 0.4470999999999999 | RDKit |
| 0.4471 | RDKit | |
| Molar Refractivity | 44.207600000000006 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 151.074561908 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
Convert
Quick conversion
MW = 151.17 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C7H9N3O.
