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Molecule
Poly(Epichlorohydrin)
CAS: 24969-06-0 · C3H5ClO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 24969-06-0
- Molecular Formula
- C3H5ClO
- Molecular Mass
- 92.53 g/mol
Identifiers
CAS Registry Number
24969-06-0
SMILES
ClCC1CO1
InChI Key
BRLQWZUYTZBJKN-UHFFFAOYSA-N
InChI
InChI=1S/C3H5ClO/c4-1-3-2-5-3/h3H,1-2H2
Names and Synonyms
- Poly(Epichlorohydrin) Common Name
- Oxirane, 2-(chloromethyl)-, homopolymer Synonym
- Propane, 1-chloro-2,3-epoxy-, polymers Synonym
- Oxirane, (chloromethyl)-, homopolymer Synonym
- Poly[(chloromethyl)ethylene oxide] Synonym
- Poly(epichlorohydrin) Synonym
- SD 2000 Synonym
- Epichlorohydrin homopolymer Synonym
- Poly(1-chloro-2,3-epoxypropane) Synonym
- HX 102 Synonym
- Sumirez KF 1D Synonym
- Sumirez Resin KF 1D Synonym
- Laproxid E 181 Synonym
- E 181 Synonym
- Epoxychloropropane homopolymer Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 92.53 g/mol | CAS Common Chemistry |
| 92.525 g/mol | RDKit | |
| 92.522 g/mol | chempirical lib | |
| Density | 1.32 g/cm³ | CAS Common Chemistry |
| 1.315 g/cm3 @ 25 °C | CAS Common Chemistry | |
| Canonical SMILES | ClCC1OC1 | CAS Common Chemistry |
| InChI | InChI=1S/C3H5ClO/c4-1-3-2-5-3/h3H,1-2H2 | CAS Common Chemistry |
| InChI Key | InChIKey=BRLQWZUYTZBJKN-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 115-120 °C | CAS Common Chemistry |
| Name | Poly(epichlorohydrin) | CAS Common Chemistry |
| Heavy Atom Count | 5 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 12.53 Ų | RDKit |
| LogP | 0.624 | RDKit |
| Molar Refractivity | 20.459999999999994 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 92.00289246 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
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200 ppm
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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MW = 92.53 g/mol; density = 1.320 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C3H5ClO.
