Back to Search
Molecule
[(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 Mass
- 140.16 g/mol
Identifiers
CAS Registry Number
51859-98-4
SMILES
NNCc1ccccc1F
InChI Key
OOMBRKGIWITBLL-UHFFFAOYSA-N
InChI
InChI=1S/C7H9FN2/c8-7-4-2-1-3-6(7)5-10-9/h1-4,10H,5,9H2
Names and Synonyms
- [(2-Fluorophenyl)Methyl]Hydrazine Common Name
- Hydrazine, [(2-fluorophenyl)methyl]- Synonym
- [(2-Fluorophenyl)methyl]hydrazine Synonym
- 2-Fluorobenzylhydrazine Synonym
- o-Fluorobenzyl hydrazine Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 140.16 g/mol | CAS Common Chemistry |
| 140.16099999999994 g/mol | RDKit | |
| 140.161 g/mol | RDKit | |
| Canonical SMILES | FC=1C=CC=CC1CNN | CAS Common Chemistry |
| InChI | InChI=1S/C7H9FN2/c8-7-4-2-1-3-6(7)5-10-9/h1-4,10H,5,9H2 | CAS Common Chemistry |
| InChI Key | InChIKey=OOMBRKGIWITBLL-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | [(2-Fluorophenyl)methyl]hydrazine | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 38.05 Ų | RDKit |
| LogP | 0.7889999999999995 | RDKit |
| 0.789 | RDKit | |
| Molar Refractivity | 37.427100000000024 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.1429 | RDKit |
| 0.14 | chempirical lib | |
| Exact Mass | 140.074976508 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 = 140.16 g/mol. Edit any field — others recompute live.
