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Phenoxyethyl Acrylate
CAS: 48145-04-6 | C11H12O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
48145-04-6
Molecular Formula:
C11H12O3
Molecular Weight:
192.21400000000003 g/mol
Names and Synonyms:
Phenoxyethyl Acrylate
2-Propenoic acid, 2-phenoxyethyl ester
2-Phenoxyethyl acrylate
Phenoxyethyl acrylate
Phenyl Cellosolve acrylate
Chemlink 160
Kayarad R 561
SR 339
PO-A
Light Ester PO-A
Viscoat 192
NK Ester AMP 10G
GX 8079
Newfrontier PHE
Photomer 4035
Sartomer SR 339
Ageflex PEA
Light Acrylate PO-A
R 561
IRR 169
Ethylene glycol monophenyl ether monoacrylate
Ethylene glycol phenyl ether acrylate
AMP 10G
Sartomer 339
SR 339A
SR 339C
Ebecryl 114
Laromer POEA
EM 210
M 8200
M 8200 (ester)
Eternal PEA
Miramer M 140
FA 310A
PHA 011
V 192
D 192
Viscoat 192D
Sartomer SR 339C
M 140
Aronix M 600A
SR 339EU
Fancryl FA 310A
Newfrontier PHA
Ethylene glycol acrylate phenyl ether
NK Ester AMO 10G
Sartomer 339C
Sartomer 399C
SR 339NS
Sartomer SR 339A
Fancryl FA 310AH
PHEA
AgiSyn 2832
2-Phenoxyethyl prop-2-enoate
Identifiers:
SMILES:
C=CC(=O)OCCOc1ccccc1
InChI:
InChI=1S/C11H12O3/c1-2-11(12)14-9-8-13-10-6-4-3-5-7-10/h2-7H,1,8-9H2
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 192.21 g/mol | Legacy Database |
| density | 1.10 g/cm³ | Legacy Database |
| cas-boiling-point | 103 °C @ Press: 0.6 Torr None | Legacy Database |
| cas-canonical-smile | O=C(OCCOC=1C=CC=CC1)C=C None | Legacy Database |
| cas-density | 1.1035 g/cm3 @ Temp: 20 °C None | Legacy Database |
| cas-inchi | InChI=1S/C11H12O3/c1-2-11(12)14-9-8-13-10-6-4-3-5-7-10/h2-7H,1,8-9H2 None | Legacy Database |
| cas-inchi-key | InChIKey=RZVINYQDSSQUKO-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Phenoxyethyl acrylate None | Legacy Database |
| LogP | 1.7946 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 192.21400000000003 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 192.078644244 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 14 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 3 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 5 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 1 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 35.53 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 53.09300000000003 | RDKit |
