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1-Phenyl-1-(Phenylmethyl)Hydrazine
CAS: 614-31-3 | C13H14N2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
614-31-3
Molecular Formula:
C13H14N2
Molecular Mass:
198.27 g/mol
Names and Synonyms:
1-Phenyl-1-(Phenylmethyl)Hydrazine
Hydrazine, 1-phenyl-1-(phenylmethyl)-
Hydrazine, 1-benzyl-1-phenyl-
1-Phenyl-1-(phenylmethyl)hydrazine
α-Benzylphenylhydrazine
1-Benzyl-1-phenylhydrazine
1-Benzylphenylhydrazine
N-Benzyl-N-phenylhydrazine
NSC 7145
Identifiers:
SMILES:
NN(Cc1ccccc1)c1ccccc1
InChI:
InChI=1S/C13H14N2/c14-15(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11,14H2
Key Properties
Boiling Point
124-127 °C @ Press: 0.55 Torr
CAS Common Chemistry
Melting Point
164-166 °C
CAS Common Chemistry
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
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 198.27 g/mol | CAS Common Chemistry |
| 198.26899999999998 g/mol | RDKit | |
| 198.115698448 g/mol | RDKit | |
| Boiling Point | 124-127 °C @ Press: 0.55 Torr | CAS Common Chemistry |
| Canonical SMILES | NN(C=1C=CC=CC1)CC=2C=CC=CC2 | CAS Common Chemistry |
| InChI | InChI=1S/C13H14N2/c14-15(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11,14H2 | CAS Common Chemistry |
| InChI Key | InChIKey=SQMOOVFBFVTTGF-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 164-166 °C | CAS Common Chemistry |
| Name | 1-Phenyl-1-(phenylmethyl)hydrazine | CAS Common Chemistry |
| Heavy Atom Count | 15 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 29.259999999999998 Ų | RDKit |
| LogP | 2.5669000000000004 | RDKit |
| Molar Refractivity | 63.25440000000003 | RDKit |
