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Allyl Chloro(Difluoro)Acetate
[CAS# 118337-48-7]

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Identification
Name Allyl Chloro(Difluoro)Acetate
Synonyms 2-chloro-2,2-difluoroacetic acid prop-2-enyl ester; CHLORO-DIFLUORO-ACETICACIDALLYLESTER; MFCD09033650
Molecular Structure CAS#: 118337-48-7, Allyl Chloro(Difluoro)Acetate
Molecular Formula C5H5ClF2O2
Molecular Weight 170.54
CAS Registry Number 118337-48-7
SMILES C=CCOC(=O)C(F)(F)Cl
InChI 1S/C5H5ClF2O2/c1-2-3-10-4(9)5(6,7)8/h2H,1,3H2
InChIKey RVOSMQFOBYVXQI-UHFFFAOYSA-N
Properties
Density 1.3±0.1g/cm3 (Cal.)
Boiling point 130.4±35.0°C at 760 mmHg (Cal.)
98°C (Expl.)
Flash point 46.4±15.1°C (Cal.)
46°C (Expl.)
Refractive index 1.398 (Cal.)
Safety Data
Safety Description S9,S16,S23,S24/25,S33,S36/37/39,S45
R10,R18,R36/37/38
Irritant/Flammable
SDS Available
References
(1) Feng Zheng, Xingang Zhang and Feng-Ling Qing. Stereoselective Reformatskii–Claisen rearrangement: synthesis of 2′,3′-dideoxy-6′,6′-difluoro-2′-thionucleosides, Chem. Commun., 2009, 1505.
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