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Butyl Methacrylate-2-Methacryloyloxyethylphosphorylcholine Copolymer
CAS: 125275-25-4 | C19H36NO8P
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
125275-25-4
Molecular Formula:
C19H36NO8P
Molecular Mass:
437.47 g/mol
Names and Synonyms:
Butyl Methacrylate-2-Methacryloyloxyethylphosphorylcholine Copolymer
3,5,8-Trioxa-4-phosphaundec-10-en-1-aminium, 4-hydroxy-N,N,N,10-tetramethyl-9-oxo-, inner salt, 4-oxide, polymer with butyl 2-methyl-2-propenoate
2-Propenoic acid, 2-methyl-, butyl ester, polymer with 4-hydroxy-N,N,N,10-tetramethyl-9-oxo-3,5,8-trioxa-4-phosphaundec-10-en-1-aminium inner salt 4-oxide
n-Butyl methacrylate-2-methacryloyloxyethylphosphorylcholine copolymer
2-Methacryloyloxyethylphosphorylcholine-butyl methacrylate copolymer
Butyl methacrylate-2-(methacryloyloxy)ethyl-2′-(trimethylammonio)ethyl phosphate copolymer
Lipidure PMB
Polyquaternium 51
Butyl methacrylate-2-methacryloyloxyethylphosphorylcholine copolymer
Butyl methacrylate-2-methacryloyloxyethylphosphocholine copolymer
Purebright MB 37-50T
Lipidure CM 5206
Lipidure PMB 82
PMB 30W
PMB 3070
Lipidure PMB(BG)
Purebright 50T
2-Methacryloyloxyethyl phosphocholine-n-butyl methacrylate copolymer
Lipidure CM 5206E
2-Methacryloyloxyethyl phosphorylcholine-n-butyl methacrylate copolymer
Lipidure B
Polyquaterium 51
Methacryloyloxyethyl phosphorylcholine-n-butyl methacrylate copolymer
CM 5206
Butyl methacrylate-2-methacryloxyethyl phosphorylcholine copolymer
Purebright MB 37-100T
Identifiers:
SMILES:
C=C(C)C(=O)OCCCC.C=C(C)C(=O)OCCOP(=O)([O-])OCC[N+](C)(C)C
InChI:
InChI=1S/C11H22NO6P.C8H14O2/c1-10(2)11(13)16-8-9-18-19(14,15)17-7-6-12(3,4)5;1-4-5-6-10-8(9)7(2)3/h1,6-9H2,2-5H3;2,4-6H2,1,3H3
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 | 437.47 g/mol | CAS Common Chemistry |
| 437.47000000000014 g/mol | RDKit | |
| 437.21785374199993 g/mol | RDKit | |
| Canonical SMILES | O=C(OCCOP(=O)([O-])OCC[N+](C)(C)C)C(=C)C.O=C(OCCCC)C(=C)C | CAS Common Chemistry |
| InChI | InChI=1S/C11H22NO6P.C8H14O2/c1-10(2)11(13)16-8-9-18-19(14,15)17-7-6-12(3,4)5;1-4-5-6-10-8(9)7(2)3/h1,6-9H2,2-5H3;2,4-6H2,1,3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=YMBGNWVYKDMNSN-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Butyl methacrylate-2-methacryloyloxyethylphosphorylcholine copolymer | CAS Common Chemistry |
| Heavy Atom Count | 29 | RDKit |
| Hydrogen Bond Acceptors | 8 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 13 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 111.19000000000001 Ų | RDKit |
| LogP | 2.2192999999999996 | RDKit |
| Molar Refractivity | 108.86390000000009 | RDKit |
