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2-Carboxyethyl Acrylate
CAS: 24615-84-7 | C6H8O4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
24615-84-7
Molecular Formula:
C6H8O4
Molecular Mass:
144.13 g/mol
Names and Synonyms:
2-Carboxyethyl Acrylate
2-Propenoic acid, 2-carboxyethyl ester
Hydracrylic acid, acrylate
2-Carboxyethyl acrylate
β-Hydroxypropionic acid acrylic ester
β-(Acryloyloxy)propionic acid
β-Carboxyethyl acrylate
3-(Acryloyloxy)propionic acid
Acrylic acid dimer
Aronix M 566
EM 231
C 800
C 800 (acrylate)
Acrylic acid 2-carboxyethyl ester
β-CEA
3-Acryloyloxypropanoic acid
Miramer CEA
Identifiers:
SMILES:
C=CC(=O)OCCC(=O)O
InChI:
InChI=1S/C6H8O4/c1-2-6(9)10-4-3-5(7)8/h2H,1,3-4H2,(H,7,8)
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 | 144.13 g/mol | CAS Common Chemistry |
| 144.126 g/mol | RDKit | |
| 144.042258736 g/mol | RDKit | |
| Canonical SMILES | O=C(OCCC(=O)O)C=C | CAS Common Chemistry |
| InChI | InChI=1S/C6H8O4/c1-2-6(9)10-4-3-5(7)8/h2H,1,3-4H2,(H,7,8) | CAS Common Chemistry |
| InChI Key | InChIKey=CYUZOYPRAQASLN-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 2-Carboxyethyl acrylate | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 63.60000000000001 Ų | RDKit |
| LogP | 0.19029999999999997 | RDKit |
| Molar Refractivity | 33.40879999999999 | RDKit |
