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(2-Fluorophenyl)Hydrazine
CAS: 2368-80-1 | C6H7FN2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2368-80-1
Molecular Formula:
C6H7FN2
Molecular Weight:
126.13399999999999 g/mol
Names and Synonyms:
(2-Fluorophenyl)Hydrazine
N-(2-Fluorophenyl)hydrazine
1-(2-Fluorophenyl)hydrazine
2-Fluorophenylhydrazine
(o-Fluorophenyl)hydrazine
(2-Fluorophenyl)hydrazine
Hydrazine, (o-fluorophenyl)-
Hydrazine, (2-fluorophenyl)-
Identifiers:
SMILES:
NNc1ccccc1F
InChI:
InChI=1S/C6H7FN2/c7-5-3-1-2-4-6(5)9-8/h1-4,9H,8H2
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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 126.13399999999999 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 126.05932644399999 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 9 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 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 | 38.05 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 1.1113000000000002 | RDKit |
| molecular_mass | 126.13 g/mol | Legacy Database |
| cas-boiling-point | 95-96 °C @ Press: 9 Torr None | Legacy Database |
| cas-canonical-smile | FC=1C=CC=CC1NN None | Legacy Database |
| cas-inchi | InChI=1S/C6H7FN2/c7-5-3-1-2-4-6(5)9-8/h1-4,9H,8H2 None | Legacy Database |
| cas-inchi-key | InChIKey=PENWGQNPFRRVQI-UHFFFAOYSA-N None | Legacy Database |
| cas-name | (2-Fluorophenyl)hydrazine None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 34.21010000000001 | RDKit |
