Back to Search
[(2-Fluorophenyl)Methyl]Hydrazine
CAS: 51859-98-4 | C7H9FN2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
51859-98-4
Molecular Formula:
C7H9FN2
Molecular Weight:
140.16099999999994 g/mol
Names and Synonyms:
[(2-Fluorophenyl)Methyl]Hydrazine
o-Fluorobenzyl hydrazine
2-Fluorobenzylhydrazine
[(2-Fluorophenyl)methyl]hydrazine
Hydrazine, [(2-fluorophenyl)methyl]-
Identifiers:
SMILES:
NNCc1ccccc1F
InChI:
InChI=1S/C7H9FN2/c8-7-4-2-1-3-6(7)5-10-9/h1-4,10H,5,9H2
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
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 2 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 2 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 | 0.7889999999999995 | RDKit |
| molecular_mass | 140.16 g/mol | Legacy Database |
| cas-canonical-smile | FC=1C=CC=CC1CNN None | Legacy Database |
| cas-inchi | InChI=1S/C7H9FN2/c8-7-4-2-1-3-6(7)5-10-9/h1-4,10H,5,9H2 None | Legacy Database |
| cas-inchi-key | InChIKey=OOMBRKGIWITBLL-UHFFFAOYSA-N None | Legacy Database |
| cas-name | [(2-Fluorophenyl)methyl]hydrazine None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 37.427100000000024 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 140.16099999999994 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 140.074976508 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 10 count | RDKit |
