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Oxirane, 2-(Chloromethyl)-, Polymer With Α-Hydro-Ω-Hydroxypoly(Oxy-1,2-Ethanediyl)
CAS: 39443-66-8 | C5H11ClO3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
39443-66-8
Molecular Formula:
C5H11ClO3
Molecular Weight:
154.593 g/mol
Names and Synonyms:
Oxirane, 2-(Chloromethyl)-, Polymer With Α-Hydro-Ω-Hydroxypoly(Oxy-1,2-Ethanediyl)
Oxirane, 2-(chloromethyl)-, polymer with α-hydro-ω-hydroxypoly(oxy-1,2-ethanediyl)
Oxirane, (chloromethyl)-, polymer with α-hydro-ω-hydroxypoly(oxy-1,2-ethanediyl)
Poly(oxy-1,2-ethanediyl), α-hydro-ω-hydroxy-, polymer with (chloromethyl)oxirane
Epichlorohydrin-polyethylene glycol polymer
Epichlorohydrin-α-hydro-ω-hydroxypoly(oxy-1,2-ethanediyl) polymer
Epichlorohydrin-polyethylene glycol copolymer
Polyethylene glycol-epichlorohydrin copolymer
Polyethylene oxide-epichlorohydrin copolymer
Identifiers:
SMILES:
ClCC1CO1.OCCO
InChI:
InChI=1S/C3H5ClO.C2H6O2/c4-1-3-2-5-3;3-1-2-4/h3H,1-2H2;3-4H,1-2H2
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
| Category | Property | Value | Source |
|---|---|---|---|
| Molecular | Molecular Weight | 154.593 g/mol | RDKit |
| Exact | Exact Molecular Weight | 154.039671892 g/mol | RDKit |
| Heavy | Heavy Atom Count | 9 count | RDKit |
| Hydrogen | Hydrogen Bond Acceptors | 3 count | RDKit |
| Hydrogen Bond Donors | 2 count | RDKit | |
| Rotatable | Rotatable Bonds | 2 count | RDKit |
| Aromatic | Aromatic Ring Count | 0 count | RDKit |
| Topological | Topological Polar Surface Area | 52.989999999999995 Ų | RDKit |
| Physical Properties | LogP | -0.40499999999999997 | RDKit |
| molecular_mass | 154.59 g/mol | Legacy Database | |
| cas-canonical-smile | ClCC1OC1.OCCO | Legacy Database | |
| cas-inchi | InChI=1S/C3H5ClO.C2H6O2/c4-1-3-2-5-3;3-1-2-4/h3H,1-2H2;3-4H,1-2H2 | Legacy Database | |
| cas-inchi-key | InChIKey=HRRFUVNAWMTOGH-UHFFFAOYSA-N | Legacy Database | |
| cas-name | Oxirane, 2-(chloromethyl)-, polymer with α-hydro-ω-hydroxypoly(oxy-1,2-ethanediyl) | Legacy Database | |
| Molar | Molar Refractivity | 34.6316 | RDKit |
