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2-Propenoic Acid, Polymer With 2-Hydroxypropyl 2-Propenoate
CAS: 55719-33-0 | C9H14O5
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
55719-33-0
Molecular Formula:
C9H14O5
Molecular Mass:
202.21 g/mol
Names and Synonyms:
2-Propenoic Acid, Polymer With 2-Hydroxypropyl 2-Propenoate
2-Propenoic acid, polymer with 2-hydroxypropyl 2-propenoate
2-Propenoic acid, 2-hydroxypropyl ester, polymer with 2-propenoic acid
Acrylic acid-2-hydroxypropyl acrylate copolymer
Identifiers:
SMILES:
C=CC(=O)O.C=CC(=O)OCC(C)O
InChI:
InChI=1S/C6H10O3.C3H4O2/c1-3-6(8)9-4-5(2)7;1-2-3(4)5/h3,5,7H,1,4H2,2H3;2H,1H2,(H,4,5)
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 | 202.21 g/mol | CAS Common Chemistry |
| 202.20599999999996 g/mol | RDKit | |
| 202.084123548 g/mol | RDKit | |
| Canonical SMILES | O=C(O)C=C.O=C(OCC(O)C)C=C | CAS Common Chemistry |
| InChI | InChI=1S/C6H10O3.C3H4O2/c1-3-6(8)9-4-5(2)7;1-2-3(4)5/h3,5,7H,1,4H2,2H3;2H,1H2,(H,4,5) | CAS Common Chemistry |
| InChI Key | InChIKey=DGZIMLVEXGVYDW-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 2-Propenoic acid, polymer with 2-hydroxypropyl 2-propenoate | CAS Common Chemistry |
| Heavy Atom Count | 14 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 83.83 Ų | RDKit |
| LogP | 0.3534 | RDKit |
| Molar Refractivity | 50.669600000000024 | RDKit |
