61382-45-4

Basic information

• Product Name: 1-Butene, 1-iodo-3,3-dimethyl-, (E)-
• Synonyms: 1t-iodo-3,3-dimethyl-but-1-ene
• CAS NO: 61382-45-4
• Molecular Formula: C6H11I
• Molecular Weight: 210.058
• Mol File: 61382-45-4.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 70-72 °C(Press: 59 Torr)
• Density: 1.499±0.06 g/cm3(Predicted)
• CAS DataBase Reference: 1-Butene, 1-iodo-3,3-dimethyl-, (E)-(CAS DataBase Reference)
• NIST Chemistry Reference: 1-Butene, 1-iodo-3,3-dimethyl-, (E)-(61382-45-4)
• EPA Substance Registry System: 1-Butene, 1-iodo-3,3-dimethyl-, (E)-(61382-45-4)

Safety Data

• Hazardous Substances Data: 61382-45-4(Hazardous Substances Data)

Upstream product

• 119145-79-8 (E)-(η1-C6Me5CH2)Ta(CH=CH(CMe3))(2,6-OC6H3(i-Pr)2)2Cl 

Downstream Products

• 4436-99-1 dineopentyl ketone 
• 38965-26-3 3,3-Dimethylbuttersaeureanhydrid 
• 1310799-99-5 (E)-1-bromo-2-(3,3-dimethylbut-1-enyl)benzene 
• 868745-23-7 Allyl-[(E)-(R)-1-tert-butyl-3-((1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl)-allyl]-carbamic acid tert-butyl ester 
• 881920-94-1 (S,E)-1-((1R,2S,5R)-2-isopropyl-5-methylcyclohexyl)-4,4-dimethylpent-2-enyl carbamate 
• 881920-70-3 (R,E)-1-((1R,2S,5R)-2-isopropyl-5-methylcyclohexyl)-4,4-dimethylpent-2-enyl carbamate 
• 868745-22-6 Allyl-[(E)-(R)-1-tert-butyl-3-((1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl)-allyl]-amine 
• 868744-90-5 (S,E)-1-((1R,2S,5R)-2-isopropyl-5-methylcyclohexyl)-4,4-dimethylpent-2-en-1-ol 
• 881920-88-3 (E)-1-((1R,2S,5R)-2-isopropyl-5-methylcyclohexyl)-4,4-dimethylpent-2-en-1-one 
• 920750-02-3 Phenyl-thiocarbamic acid S-[(E)-(S)-1-tert-butyl-3-((1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl)-allyl] ester 

Relevant articles and documents

Evidence for Intramolecular C-H Bond Activation and the Formation of a "Tucked-In" Complex of Hexamethylbenzene at a Tantalum(III) Center

The reactions of the d2 tantalum complex (η6-C6Me6)Ta(OR)2Cl (1, OR=2,6-diisopropylphenoxide) with 3,3-dimethyl-1-butyne and 3-chloropropene provide the η1-pentamethylbenzyl compounds (E)-(η1-C6Me5CH2)Ta(CH=CH-(CMe3))(OR)2Cl (3) and (η1-C6Me5CH2)Ta(CH2CH2CH2Cl)(OR)2Cl (5), respectively.Both complexes are proposed to have arisen through the intermediacy of an unprecedented d0 "tucked-in" hexamethylbenzene compound, viz. (η6,η1-C6Me5CH2)Ta(H)(OR)2Cl (4).The intramolecular metalation of a methyl C-H bond in 1 and the existence of a hydride intermediate are also inferred from various deuterium labeling and kinetics studies.The metalated hexamethylbenzene can be functionalized selectively as demonstrated in the iodination of 3 to form C6(CH3)5CH2I and (E)-CHI=CH(CMe3).