31702-33-7

Basic information

• Product Name: 1,1,3-Trichloro-2-methyl-1-propene
• Synonyms: 1,1,3-Trichloro-2-methyl-1-propene
• CAS NO: 31702-33-7
• Molecular Formula: C₄H₅Cl₃
• Molecular Weight: 159.4415
• Mol File: 31702-33-7.mol
• Article Data: 4

Chemical Properties

• Boiling Point: 153.85°C
• Flash Point: 86.8°C
• Appearance: /
• Density: 1.3460
• Vapor Pressure: 3.8mmHg at 25°C
• Refractive Index: 1.4990
• CAS DataBase Reference: 1,1,3-Trichloro-2-methyl-1-propene(CAS DataBase Reference)
• NIST Chemistry Reference: 1,1,3-Trichloro-2-methyl-1-propene(31702-33-7)
• EPA Substance Registry System: 1,1,3-Trichloro-2-methyl-1-propene(31702-33-7)

Safety Data

• Hazardous Substances Data: 31702-33-7(Hazardous Substances Data)

Usage

InChI:InChI=1/C4H5Cl3/c1-3(2-5)4(6)7/h2H2,1H3

Upstream product

• 4749-27-3 3,3,3-trichloro-2-methyl-1-propene 
• 5435-44-9 (E)-3-Ureido-but-2-enoic acid ethyl ester 
• 2678-54-8 ketene diethyl acetal 
• 57-15-8 1,1,1-trichloro-2-methyl-2-propanol 
• 115-11-7 isobutene 
• 7719-09-7 thionyl chloride 
• 75-58-1 tertamethylammonium iodide 
• 91-22-5 quinoline 
• 7647-01-0 hydrogenchloride 
• 7446-70-0 aluminium trichloride 
• 10026-13-8 phosphorus pentachloride 
• 7664-93-9 sulfuric acid 
• 7664-39-3 hydrogen fluoride 
• 7705-08-0 iron(III) chloride 

Downstream Products

• 98995-00-7 (3,3-dichloro-2-methyl-allyl)-pentachlorophenyl ether 
• 100614-75-3 2-(3,3-dichloro-2-methyl-allyl)-4-isopropyl-phenol 
• 100721-90-2 4-tert-butyl-2-(3,3-dichloro-2-methyl-allyl)-phenol 
• 103263-90-7 (2-chloro-phenyl)-(3,3-dichloro-2-methyl-allyl)-ether 
• 106381-19-5 4-tert-butyl-2-chloro-6-(3,3-dichloro-2-methyl-allyl)-phenol 
• 4749-31-9 1,1,1,2,3-pentachloro-2-methyl-propane 
• 99360-94-8 (3,3-dichloro-2-methyl-allyl)-(2,4-dichloro-phenyl)-ether 
• 38862-80-5 1,1-dichloro-2-methyl-3-phenyl-propene 
• 90086-61-6 Bis-(3.3-dichlor-2-methallyl)-amin 
• 78-95-5 chloroacetone 
• 100122-63-2 2-(3,3-dichloro-2-methyl-allyloxy)-benzoic acid methyl ester 
• 103906-69-0 4-(3,3-dichloro-2-methyl-allyl)-phenol 
• 103905-80-2 2-(3,3-dichloro-2-methyl-allyl)-phenol 
• 107100-88-9 3,6-bis-(3,3-dichloro-2-methyl-allyl)-2,4-dimethyl-phenol 

Relevant articles and documents

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Thermal cyclopropyl—allyl rearrangement of gem-chlorofluorocyclopropanes under gas-phase pyrolysis conditions. Formation of chlorofluoroalkenes and 2-fluorobuta-1,3-dienes

The gas-phase pyrolysis of isomeric 2-chloro-2-fluoro-1-phenylcyclopropanes in a flow reactor at 250–430 °С gives 1-phenyl- and 3-phenyl-3-chloro-2-fluoropropenes. Under similar conditions, methyl-substituted gem-chlorofluorocyclopropanes undergo cyclopropyl—allyl isomerization accompanied by dehydrochlorination to form chlorofluoroalkenes and 2-fluoro-buta-1,3-dienes.

Correlation of Alkyl and Polar Substituents at the Alcoholic Side of Tertiary Acetates with the Rate of Pyrolyses in the Gas Phase

The rate coefficients for the gas-phase pyrolysis of several tertiary acetates have been measured in a static system over the temperature range of 220-340 deg C and pressure range of 40-186 torr.In seasoned vessels the reactions are homogeneous, follow a first-order rate law, and are unimolecular.The temperature dependence of the rate coefficients is given by the following Arrhenius equations: for 3,3,3-trichloro-2-methyl-2-propyl acetate, log k1 (s-1) = (13.86 +/- 0.35) - (188.8 +/- 3.8) kJ mol-1 (2.303 RT)-1; for methyl α-acetoxyisobutyrate, log k1 (s-1) = (12.42 +/- 0.28) - (174.6 +/- 3.2) kJ mol-1 (2.303 RT)-1; for 2-methyl-2-hexyl acetate, log k1 (s-1) = (13.35 +/- 0.33) - (166.1 +/- 3.4) kJ mol-1 (2.303 RT)-1; for 2,4-dimethyl-2-pentyl acetate, log k1 (s-1) = (12.42 +/- 0.19) - (154.1 +/- 1.9) kJ mol-1 (2.303 RT)-1; for 2-methyl-2-acetoxy-4-phenylbutane, log k1 (s-1) = (11.97 +/- 0.55) - (151.5 +/-5.6) kJ mol-1 (2.303 RT)-1.The effectof substituents in the gas-phase elimination of 2-substituted 2-propyl acetates may be either electronic or steric in nature.The linear correlations for electron-releasing groups and for electron-withdrawing groups are presented and discussed.The results of the present work together with those reported in the literature lead to the establishment of a possible generalization on the influence of substituents at the alcohols side of primary, secondary, and tertiary acetates pyrolyses in the gas phase.