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Acetaldehyde, Homopolymer
CAS: 9002-91-9 | C2H4O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
9002-91-9
Molecular Formula:
C2H4O
Molecular Weight:
44.053 g/mol
Names and Synonyms:
Acetaldehyde, Homopolymer
Synonym
Acetaldehyde, homopolymer
Synonym
Acetaldehyde, polymers
Synonym
Polyacetaldehyde
Synonym
Metaldehyde
Synonym
Acetaldehyde polymer
Synonym
Limovet
Synonym
Limax
Synonym
Slugit
Synonym
Meta
Synonym
Polyethanal
Synonym
Identifiers:
SMILES:
CC=O
InChI:
InChI=1S/C2H4O/c1-2-3/h2H,1H3
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 | 44.053 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 44.026214748 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 3 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 1 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 | 17.07 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 0.2052 | RDKit |
| molecular_mass | 44.05 g/mol | Legacy Database |
| cas-canonical-smile | O=CC None | Legacy Database |
| cas-inchi | InChI=1S/C2H4O/c1-2-3/h2H,1H3 None | Legacy Database |
| cas-inchi-key | InChIKey=IKHGUXGNUITLKF-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 165 °C None | Legacy Database |
| cas-name | Acetaldehyde, homopolymer None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 11.738000000000001 | RDKit |