Back to Search
Vinyl Norbornene
CAS: 3048-64-4 | C9H12
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
3048-64-4
Molecular Formula:
C9H12
Molecular Weight:
120.19499999999996 g/mol
Names and Synonyms:
Vinyl Norbornene
Bicyclo[2.2.1]hept-2-ene, 5-ethenyl-
2-Norbornene, 5-vinyl-
5-Ethenylbicyclo[2.2.1]hept-2-ene
5-Vinyl-2-norbornene
5-Vinylbicyclo[2.2.1]hept-2-ene
5-Vinylnorbornene
2-Vinylbicyclo[2.2.1]hept-5-ene
2-Vinyl-5-norbornene
Vinylnorbornene
2-Vinylnorbornene
VBH
NSC 61529
V 0062
6-Vinylbicyclo[2.2.1]hept-2-ene
Identifiers:
SMILES:
C=CC1CC2C=CC1C2
InChI:
InChI=1S/C9H12/c1-2-8-5-7-3-4-9(8)6-7/h2-4,7-9H,1,5-6H2
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 120.19 g/mol | Legacy Database |
| density | 0.89 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Vinyl_norbornene None | Legacy Database |
| cas-boiling-point | 140.4 °C @ Press: 760 Torr None | Legacy Database |
| cas-canonical-smile | C=CC1CC2C=CC1C2 None | Legacy Database |
| cas-density | 0.8884 g/cm3 @ Temp: 20 °C None | Legacy Database |
| cas-inchi | InChI=1S/C9H12/c1-2-8-5-7-3-4-9(8)6-7/h2-4,7-9H,1,5-6H2 None | Legacy Database |
| cas-inchi-key | InChIKey=INYHZQLKOKTDAI-UHFFFAOYSA-N None | Legacy Database |
| cas-name | 5-Vinyl-2-norbornene None | Legacy Database |
| wikipedia-name | Vinyl norbornene None | Legacy Database |
| LogP | 2.3846000000000007 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 120.19499999999996 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 120.093900384 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 9 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 0 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 1 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 0.0 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 39.041000000000004 | RDKit |
