ChemicalBook--->CAS DataBase List--->118336-86-0

118336-86-0

118336-86-0 Structure

118336-86-0 Structure
IdentificationBack Directory
[Name]

2-(4-CHLOROBUTYL)-1,3-DIOXOLANE
[CAS]

118336-86-0
[Synonyms]

2-(4-CHLOROBUTYL)-1,3-DIOXOLANE
1,3-Dioxolane,2-(4-chlorobutyl)-
5-CHLORO-N-VALERALDEHYDE ETHYLENE ACETAL
[Molecular Formula]

C7H13ClO2
[MDL Number]

MFCD00043136
[MOL File]

118336-86-0.mol
[Molecular Weight]

164.63
Chemical PropertiesBack Directory
[Boiling point ]

56-58 °C/0.1 mmHg (lit.)
[density ]

1.109 g/mL at 20 °C (lit.)
[refractive index ]

n20/D 1.457
[Fp ]

85 °C
[storage temp. ]

Inert atmosphere,2-8°C
[form ]

liquid
[BRN ]

4304948
[InChI]

InChI=1S/C7H13ClO2/c8-4-2-1-3-7-9-5-6-10-7/h7H,1-6H2
[InChIKey]

GFTDGDAKGDUYGO-UHFFFAOYSA-N
[SMILES]

O1CCOC1CCCCCl
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22
[RIDADR ]

UN 2810 6.1/PG 3
[WGK Germany ]

3
[F ]

21
[HS Code ]

2932990090
Hazard InformationBack Directory
[Uses]

2-(4-Chlorobutyl)-1,3-dioxolane was used in the synthesis of C-chlorobutylpyrogallol[4]arene.
[Purification Methods]

If the IR has no CHO band, then just distil it in a vacuum. If it is present, then dissolve it in Et2O, wash it with H2O, then saturated NaHCO3, dry over MgSO4, evaporate and distil it. [cf Kriesat & Gisvold J Pharm Sci 60 1250 1971, Loftfield J Am Chem Soc 73 1365 1951.]
Spectrum DetailBack Directory
[Spectrum Detail]

2-(4-CHLOROBUTYL)-1,3-DIOXOLANE(118336-86-0)1HNMR
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