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NSC 8263
CAS: 140-88-5 | C5H8O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
140-88-5
Molecular Formula:
C5H8O2
Names and Synonyms:
NSC 8263
Ethyl Acrylate
2-Propenoic acid, ethyl ester
Acrylic acid ethyl ester
Ethyl acrylate
Ethyl propenoate
2-Propenoic acid ethyl ester
Ethyl 2-propenoate
Ethyl acrylic ester
A 0143
Identifiers:
SMILES:
C=CC(=O)OCC
InChI:
InChI=1S/C5H8O2/c1-3-5(6)7-4-2/h3H,1,4H2,2H3
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 |
|---|---|---|
| Physical Properties | 100.12 g/mol | Legacy Database |
| 0.92 g/cm³ | Legacy Database | |
| https://en.wikipedia.org/wiki/Ethyl_acrylate | Legacy Database | |
| 99.4 °C | Legacy Database | |
| O=C(OCC)C=C | Legacy Database | |
| 0.9234 g/cm3 @ Temp: 20 °C | Legacy Database | |
| InChI=1S/C5H8O2/c1-3-5(6)7-4-2/h3H,1,4H2,2H3 | Legacy Database | |
| InChIKey=JIGUQPWFLRLWPJ-UHFFFAOYSA-N | Legacy Database | |
| -71.2 °C | Legacy Database | |
| Ethyl acrylate | Legacy Database | |
| Ethyl acrylate | Legacy Database | |
| 0.7354999999999999 | RDKit | |
| Molecular | 100.11699999999999 g/mol | RDKit |
| Exact | 100.052429496 g/mol | RDKit |
| Heavy | 7 count | RDKit |
| Hydrogen | 2 count | RDKit |
| 0 count | RDKit | |
| Rotatable | 2 count | RDKit |
| Aromatic | 0 count | RDKit |
| Topological | 26.3 Ų | RDKit |
| Molar | 26.829999999999988 | RDKit |
