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2-Hydrazinopyridine
CAS: 4930-98-7 | C5H7N3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
4930-98-7
Molecular Formula:
C5H7N3
Molecular Weight:
109.13199999999999 g/mol
Names and Synonyms:
2-Hydrazinopyridine
(Pyridin-2-yl)hydrazine
NSC 76877
2-Pyridinylhydrazine
α-Pyridylhydrazine
Hydrazine, 2-pyridinyl-
2-Hydrazinopyridine
2-Pyridylhydrazine
2-Hydrazinylpyridine
2(1H)-Pyridinone, hydrazone
Pyridine, 2-hydrazino-
Pyridine, 2-hydrazinyl-
Identifiers:
SMILES:
NNc1ccccn1
InChI:
InChI=1S/C5H7N3/c6-8-5-3-1-2-4-7-5/h1-4H,6H2,(H,7,8)
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
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.
All Properties
Comprehensive physical and chemical properties
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 109.13 g/mol | Legacy Database |
| cas-boiling-point | 185 °C @ Press: 140 Torr None | Legacy Database |
| cas-canonical-smile | N(N)=C1C=CC=CN1 None | Legacy Database |
| cas-inchi | InChI=1S/C5H7N3/c6-8-5-3-1-2-4-7-5/h1-4H,6H2,(H,7,8) None | Legacy Database |
| cas-inchi-key | InChIKey=NWELCUKYUCBVKK-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 46.6 °C None | Legacy Database |
| cas-name | 2-Hydrazinopyridine None | Legacy Database |
| LogP | 0.3672000000000001 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 109.13199999999999 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 109.06399722399999 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 8 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 3 count | RDKit |
| Hydrogen Bond Donors | 2 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 1 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 1 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 50.94 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 32.04710000000001 | RDKit |
