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N,N′-Diphenylethylenediamine
CAS: 150-61-8 | C14H16N2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
150-61-8
Molecular Formula:
C14H16N2
Molecular Mass:
212.30 g/mol
Names and Synonyms:
N,N′-Diphenylethylenediamine
1,2-Ethanediamine, N1,N2-diphenyl-
Ethylenediamine, N,N′-diphenyl-
1,2-Ethanediamine, N,N′-diphenyl-
N1,N2-Diphenyl-1,2-ethanediamine
1,2-Dianilinoethane
N,N′-Diphenyl-α,ω-diaminoethane
N,N′-Diphenylethylenediamine
NODX
N,N′-Diphenyl-1,2-ethylenediamine
sym-Diphenylethylenediamine
Benzenamine, N,N′-1,2-ethanediylbis-
N,N′-Ethylenedianiline
Stabilite
N,N′-Diphenyl-1,2-ethanediamine
Stabilite (antioxidant)
1,2-Bis(phenylamino)ethane
N,N′-Diphenyl-1,2-diaminoethane
NSC 8719
N1,N2-Diphenylethane-1,2-diamine
1,2-Ethanediamine N1,N2-diphenyl-
Identifiers:
SMILES:
c1ccc(NCCNc2ccccc2)cc1
InChI:
InChI=1S/C14H16N2/c1-3-7-13(8-4-1)15-11-12-16-14-9-5-2-6-10-14/h1-10,15-16H,11-12H2
Key Properties
Boiling Point
178-182 °C @ Press: 2 Torr
CAS Common Chemistry
Melting Point
74 °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 | 212.30 g/mol | CAS Common Chemistry |
| 212.29600000000005 g/mol | RDKit | |
| 212.131348512 g/mol | RDKit | |
| Boiling Point | 178-182 °C @ Press: 2 Torr | CAS Common Chemistry |
| Canonical SMILES | C=1C=CC(=CC1)NCCNC=2C=CC=CC2 | CAS Common Chemistry |
| InChI | InChI=1S/C14H16N2/c1-3-7-13(8-4-1)15-11-12-16-14-9-5-2-6-10-14/h1-10,15-16H,11-12H2 | CAS Common Chemistry |
| InChI Key | InChIKey=NOUUUQMKVOUUNR-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 74 °C | CAS Common Chemistry |
| Name | N,N′-Diphenylethylenediamine | CAS Common Chemistry |
| Heavy Atom Count | 16 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 5 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 24.06 Ų | RDKit |
| LogP | 3.2106000000000012 | RDKit |
| Molar Refractivity | 69.86340000000003 | RDKit |
