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Vinyl Chloride
CAS: 75-01-4 | C2H3Cl
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
75-01-4
Molecular Formula:
C2H3Cl
Molecular Weight:
62.498999999999995 g/mol
Names and Synonyms:
Vinyl Chloride
Common Name
F 1140
Synonym
1-Chloroethylene
Synonym
1-Chloroethene
Synonym
VCM
Synonym
Vinyl chloride monomer
Synonym
Vinyl chloride
Synonym
Monochloroethylene
Synonym
Vinyl C monomer
Synonym
Chloroethylene
Synonym
Chloroethene
Synonym
Ethylene, chloro-
Synonym
Ethene, chloro-
Synonym
Identifiers:
SMILES:
C=CCl
InChI:
InChI=1S/C2H3Cl/c1-2-3/h2H,1H2
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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 62.498999999999995 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 61.992327775999996 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 3 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 0 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 0.0 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 1.3687 | RDKit |
| cas-canonical-smile | ClC=C None | Legacy Database |
| molecular_mass | 62.50 g/mol | Legacy Database |
| density | 0.91 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Vinyl_chloride None | Legacy Database |
| cas-boiling-point | -13.3 °C None | Legacy Database |
| cas-density | 0.9106 g/cm3 @ Temp: 20 °C None | Legacy Database |
| cas-inchi | InChI=1S/C2H3Cl/c1-2-3/h2H,1H2 None | Legacy Database |
| cas-inchi-key | InChIKey=BZHJMEDXRYGGRV-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | -153.7 °C None | Legacy Database |
| cas-name | Vinyl chloride None | Legacy Database |
| wikipedia-name | Vinyl chloride None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 16.05 | RDKit |