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N,N-Diphenylhydrazine
CAS: 530-50-7 | C12H12N2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
530-50-7
Molecular Formula:
C12H12N2
Molecular Mass:
184.24 g/mol
Names and Synonyms:
N,N-Diphenylhydrazine
Hydrazine, 1,1-diphenyl-
1,1-Diphenylhydrazine
α,α-Diphenylhydrazine
N,N-Diphenylhydrazine
Identifiers:
SMILES:
NN(c1ccccc1)c1ccccc1
InChI:
InChI=1S/C12H12N2/c13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,13H2
Key Properties
Boiling Point
220 °C @ Press: 40 Torr
CAS Common Chemistry
Melting Point
50.5 °C
CAS Common Chemistry
Density
1.19 g/cm³
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 | 184.24 g/mol | CAS Common Chemistry |
| 184.242 g/mol | RDKit | |
| 184.100048384 g/mol | RDKit | |
| Density | 1.19 g/cm³ | CAS Common Chemistry |
| 1.190 g/cm3 @ Temp: 16 °C | CAS Common Chemistry | |
| Boiling Point | 220 °C @ Press: 40 Torr | CAS Common Chemistry |
| Canonical SMILES | NN(C=1C=CC=CC1)C=2C=CC=CC2 | CAS Common Chemistry |
| InChI | InChI=1S/C12H12N2/c13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,13H2 | CAS Common Chemistry |
| InChI Key | InChIKey=YHYKLKNNBYLTQY-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 50.5 °C | CAS Common Chemistry |
| Name | N,N-Diphenylhydrazine | CAS Common Chemistry |
| Heavy Atom Count | 14 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 29.259999999999998 Ų | RDKit |
| LogP | 2.6984000000000012 | RDKit |
| Molar Refractivity | 59.21040000000003 | RDKit |
