Basic information
- Name:
Cyclopropanecarbonylchloride, 3-(2,2-dichloroethenyl)-2,2-dimethyl-
- Superlist Name:
- 3-(2,2-Dichlorovinyl)-2,2-dimethylcyclopropanecarbonyl chloride
- CAS No.:
52314-67-7
- Molecular Structure:
- Formula:
- C8H9Cl3O
- Molecular Weight:
- 227.52
- Deleted CAS:
- 78491-05-1
- Synonyms:
- 2,2-Dimethyl-3-(2,2-dichloroethenyl)cyclopropanecarbonylchloride;2,2-Dimethyl-3-(2,2-dichlorovinyl)cyclopropanecarbonyl chloride;3-(2,2-Dichloroethenyl)-2,2-dimethylcyclopropanecarbonyl chloride;3-(2,2-Dichlorovinyl)-2,2-dimethyl-1-cyclopropanecarbonyl chloride;3-(2,2-Dichlorovinyl)-2,2-dimethylcyclopropanecarbonyl chloride;
- EINECS:
- 257-840-8
- Density:
- 1.424 g/cm3
- Boiling Point:
- 242.4 °C at 760 mmHg
- Flash Point:
- 98.9 °C
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Specification
The CAS register number of Cyclopropanecarbonylchloride, 3-(2,2-dichloroethenyl)-2,2-dimethyl- is 52314-67-7. It also can be called as 2,2-Dimethyl-3-(2,2-dichloroethenyl)cyclopropanecarbonylchloride and the IUPAC name about this chemical is 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carbonyl chloride. The molecular formula about this chemical is C8H9Cl3O and the molecular weight is 227.52.
Physical properties about Cyclopropanecarbonylchloride, 3-(2,2-dichloroethenyl)-2,2-dimethyl- are: (1)ACD/LogP: 3.27; (2)ACD/LogD (pH 5.5): 3.27; (3)ACD/LogD (pH 7.4): 3.27; (4)ACD/BCF (pH 5.5): 181.28; (5)ACD/BCF (pH 7.4): 181.28; (6)ACD/KOC (pH 5.5): 1439.24; (7)ACD/KOC (pH 7.4): 1439.24; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 17.07Å2; (11)Index of Refraction: 1.58; (12)Molar Refractivity: 53.23 cm3; (13)Molar Volume: 159.7 cm3; (14) Polarizability: 21.1x10-24cm3; (15)Surface Tension: 47.2 dyne/cm; (16)Enthalpy of Vaporization: 47.93 kJ/mol; (17)Boiling Point: 242.4 °C at 760 mmHg; (18)Vapour Pressure: 0.0341 mmHg at 25°C.
Uses of Cyclopropanecarbonylchloride, 3-(2,2-dichloroethenyl)-2,2-dimethyl-: it can be used to produce 3-(2,2-dichloro-vinyl)-2,2-dimethyl-cyclopropanecarboxylic acid 1-benzo[1,3]dioxol-5-yl-2,2,2-trichloro-ethyl ester with 1-benzo[1,3]dioxol-5-yl-2,2,2-trichloro-ethanol at temperature of 20 ℃. This reaction will need reagent pyridine and solvent benzene with reaction time of 12 hours. The yield is about 73.9%.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl/C(Cl)=C/C1C(C(Cl)=O)C1(C)C
(2)InChI: InChI=1/C8H9Cl3O/c1-8(2)4(3-5(9)10)6(8)7(11)12/h3-4,6H,1-2H3
(3)InChIKey: CHLAOFANYRDCPD-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C8H9Cl3O/c1-8(2)4(3-5(9)10)6(8)7(11)12/h3-4,6H,1-2H3
(5)Std. InChIKey: CHLAOFANYRDCPD-UHFFFAOYSA-N