Back to Search
Pentaerythritol Tetraacrylate
CAS: 4986-89-4 | C17H20O8
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
4986-89-4
Molecular Formula:
C17H20O8
Molecular Weight:
352.33900000000017 g/mol
Names and Synonyms:
Pentaerythritol Tetraacrylate
Aronix M 420
[3-Prop-2-enoyloxy-2,2-bis(prop-2-enoyloxymethyl)propyl] prop-2-enoate
PE 4A
Sarbio 5400
SR 295NS
PETA 408263
Pentaerythrytol tetraacrylate
PETTA
CD 295
Sartomer CD 295
Ebecryl 180
Etermer EM 241
PET 4A
Miramer M 420
M 420
Neomer EA 300
EM 241
Light Acrylate DPE 4A
Viscoat 400
Saret SR 295
Kayarad SR 295
SR 295 (acrylate)
BS 710
Kayarad A-TMMT
NK Ester A-YMMT
Sartomer SR 295
Beam Set 710
Kayarad PET 40
A-TMMT
Aronix M 450
M 450
Pentaerythritol tetraacrylate
Light Acrylate PE 4A
Sartomer 295
NK Ester A-TMMT
SR 295
Tetramethylolmethane tetraacrylate
Acrylic acid, tetraester with pentaerythritol
2-Propenoic acid, 2,2-bis[[(1-oxo-2-propenyl)oxy]methyl]-1,3-propanediyl ester
Acrylic acid, neopentanetetrayl ester
2-Propenoic acid, 1,1′-[2,2-bis[[(1-oxo-2-propen-1-yl)oxy]methyl]-1,3-propanediyl] ester
Identifiers:
SMILES:
C=CC(=O)OCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C
InChI:
InChI=1S/C17H20O8/c1-5-13(18)22-9-17(10-23-14(19)6-2,11-24-15(20)7-3)12-25-16(21)8-4/h5-8H,1-4,9-12H2
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 | 352.33900000000017 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 352.11581759999996 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 25 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 8 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 12 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 105.20000000000002 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 0.8895999999999997 | RDKit |
| molecular_mass | 352.34 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Pentaerythritol_tetraacrylate None | Legacy Database |
| cas-canonical-smile | O=C(OCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C)C=C None | Legacy Database |
| cas-inchi | InChI=1S/C17H20O8/c1-5-13(18)22-9-17(10-23-14(19)6-2,11-24-15(20)7-3)12-25-16(21)8-4/h5-8H,1-4,9-12H2 None | Legacy Database |
| cas-inchi-key | InChIKey=KNSXNCFKSZZHEA-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Pentaerythritol tetraacrylate None | Legacy Database |
| wikipedia-name | Pentaerythritol tetraacrylate None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 87.05700000000003 | RDKit |
