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Vinyldiphenylphosphine
CAS: 2155-96-6 | C14H13P
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2155-96-6
Molecular Formula:
C14H13P
Molecular Mass:
212.23 g/mol
Names and Synonyms:
Vinyldiphenylphosphine
Phosphine, ethenyldiphenyl-
Phosphine, diphenylvinyl-
Ethenyldiphenylphosphine
Diphenylvinylphosphine
Vinyldiphenylphosphine
NSC 151257
Identifiers:
SMILES:
C=CP(c1ccccc1)c1ccccc1
InChI:
InChI=1S/C14H13P/c1-2-15(13-9-5-3-6-10-13)14-11-7-4-8-12-14/h2-12H,1H2
Key Properties
Boiling Point
104 °C @ Press: 0.25 Torr
CAS Common Chemistry
Melting Point
70.5-71.5 °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 | 212.23 g/mol | CAS Common Chemistry |
| 212.232 g/mol | RDKit | |
| 212.075487046 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Vinyldiphenylphosphine | CAS Common Chemistry |
| Boiling Point | 104 °C @ Press: 0.25 Torr | CAS Common Chemistry |
| Canonical SMILES | C=CP(C=1C=CC=CC1)C=2C=CC=CC2 | CAS Common Chemistry |
| InChI | InChI=1S/C14H13P/c1-2-15(13-9-5-3-6-10-13)14-11-7-4-8-12-14/h2-12H,1H2 | CAS Common Chemistry |
| InChI Key | InChIKey=AJVBXLXLODZUME-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 70.5-71.5 °C | CAS Common Chemistry |
| Name | Diphenylvinylphosphine | CAS Common Chemistry |
| Vinyldiphenylphosphine | CAS Common Chemistry | |
| Heavy Atom Count | 15 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 3.2628000000000013 | RDKit |
| Molar Refractivity | 69.26900000000003 | RDKit |
