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| CAS No.: | 619-33-0 |
|---|---|
| Name: | 2,2-Dichloro-1,1-diethoxyethane |
| Molecular Structure: | |
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| Formula: | C6H12Cl2O2 |
| Molecular Weight: | 187.066 |
| Synonyms: | Acetaldehyde,dichloro-, diethyl acetal (6CI,7CI,8CI);1,1-Dichloro-2,2-diethoxyethane;2,2-Dichloro-1,1-diethoxyethane;Dichloroacetaldehyde diethyl acetal; |
| EINECS: | 210-591-9 |
| Density: | 1.141g/cm3 |
| Boiling Point: | 183.5 °C at 760 mmHg |
| Flash Point: | 60 °C |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36/37/39 |
| Transport Information: | UN 1993 |
| PSA: | 18.46000 |
| LogP: | 2.18920 |
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Specification
The Ethane,1,1-dichloro-2,2-diethoxy-, with CAS registry number 619-33-0, has the systematic name of Ethane, 1,1-dichloro-2,2-diethoxy-. And its IUPAC name is 1,1-dichloro-2,2-diethoxyethane. This chemical should be stored at the temperature of 2-8℃. What's more, its EINECS is 210-591-9.
Physical properties of Ethane,1,1-dichloro-2,2-diethoxy-: (1)ACD/LogP: 2.54; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.54; (4)ACD/LogD (pH 7.4): 2.54; (5)#H bond acceptors: 2; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 5; (8)Polar Surface Area: 18.46 Å2; (9)Index of Refraction: 1.437; (10)Molar Refractivity: 42.95 cm3; (11)Molar Volume: 163.8 cm3; (12)Polarizability: 17.02×10-24cm3; (13)Surface Tension: 29.5 dyne/cm; (14)Enthalpy of Vaporization: 40.25 kJ/mol; (15)Vapour Pressure: 1.05 mmHg at 25°C.
Uses of Ethane,1,1-dichloro-2,2-diethoxy-: it can be used to produce dichloroacetaldehyde. This reaction will need reagent sulfuric acid.
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When you are using this chemical, please be cautious about it as the following:
The Ethane,1,1-dichloro-2,2-diethoxy- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: ClC(Cl)C(OCC)OCC
(2)InChI: InChI=1/C6H12Cl2O2/c1-3-9-6(5(7)8)10-4-2/h5-6H,3-4H2,1-2H3
(3)InChIKey: CDHLQZJRWKQATP-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C6H12Cl2O2/c1-3-9-6(5(7)8)10-4-2/h5-6H,3-4H2,1-2H3
(5)Std. InChIKey: CDHLQZJRWKQATP-UHFFFAOYSA-N