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Molecule
Dichlormid
CAS: 37764-25-3 · C8H11Cl2NO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 37764-25-3
- Molecular Formula
- C8H11Cl2NO
- Molecular Mass
- 208.09 g/mol
Identifiers
CAS Registry Number
37764-25-3
SMILES
C=CCN(CC=C)C(=O)C(Cl)Cl
InChI Key
YRMLFORXOOIJDR-UHFFFAOYSA-N
InChI
InChI=1S/C8H11Cl2NO/c1-3-5-11(6-4-2)8(12)7(9)10/h3-4,7H,1-2,5-6H2
Names and Synonyms
- Dichlormid Synonym
- Stauffer R 25788 Synonym
- N,N-Diallyl-α,α-dichloroacetamide Synonym
- Dichlormid Synonym
- Acetamide, 2,2-dichloro-N,N-di-2-propen-1-yl- Synonym
- Acetamide, 2,2-dichloro-N,N-di-2-propenyl- Synonym
- Acetamide, N,N-diallyl-2,2-dichloro- Synonym
- 2,2-Dichloro-N,N-di-2-propen-1-ylacetamide Synonym
- N,N-Diallyl-2,2-dichloroacetamide Synonym
- R 25788 Synonym
- N,N-Diallyldichloroacetamide Synonym
- 2,2-Dichloro-N,N-bis(prop-2-enyl)acetamide Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 208.09 g/mol | CAS Common Chemistry |
| 208.088 g/mol | RDKit | |
| 208.082 g/mol | chempirical lib | |
| Boiling Point | 130 °C | CAS Common Chemistry |
| Canonical SMILES | O=C(N(CC=C)CC=C)C(Cl)Cl | CAS Common Chemistry |
| InChI | InChI=1S/C8H11Cl2NO/c1-3-5-11(6-4-2)8(12)7(9)10/h3-4,7H,1-2,5-6H2 | CAS Common Chemistry |
| InChI Key | InChIKey=YRMLFORXOOIJDR-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 5.5 °C | CAS Common Chemistry |
| Name | Dichlormid | CAS Common Chemistry |
| Heavy Atom Count | 12 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 5 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 20.310000000000002 Ų | RDKit |
| 20.31 Ų | RDKit | |
| 20.08 Ų | chempirical lib | |
| LogP | 1.9907 | RDKit |
| Molar Refractivity | 52.468000000000025 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.375 | RDKit |
| 0.38 | chempirical lib | |
| Exact Mass | 207.021769332 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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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 = 208.09 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C8H11Cl2NO.
