113391-65-4 Usage
Chemical class
Thiol
Explanation
Thiols are a class of organic compounds that contain a sulfur atom bonded to a hydrogen atom. They are known for their strong, pungent odor.
Explanation
The fluorine atom is part of the molecular structure, specifically bonded to the benzene ring, which influences the compound's reactivity and properties.
Explanation
1,3-Benzenedimethanethiol, 2-fluoro- serves as a building block or precursor in the synthesis of more complex organic molecules, particularly in the fields of organic chemistry and pharmaceutical research.
Explanation
Thiol compounds, including 1,3-Benzenedimethanethiol, 2-fluoro-, are known for their strong, distinctive odors. In this case, the odor is described as pungent and similar to that of garlic.
Explanation
Due to the compound's reactivity and potential hazards, it is essential to follow safety protocols when handling 1,3-Benzenedimethanethiol, 2-fluoro-. This may include wearing appropriate personal protective equipment (PPE) and working in a well-ventilated area.
Presence of fluorine atom
Attached to the benzene ring
Use
Synthetic intermediate in organic chemistry and pharmaceutical research
Odor
Pungent, garlic-like smell
Safety precautions
Proper handling required
Check Digit Verification of cas no
The CAS Registry Mumber 113391-65-4 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,3,3,9 and 1 respectively; the second part has 2 digits, 6 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 113391-65:
(8*1)+(7*1)+(6*3)+(5*3)+(4*9)+(3*1)+(2*6)+(1*5)=104
104 % 10 = 4
So 113391-65-4 is a valid CAS Registry Number.
113391-65-4Relevant academic research and scientific papers
Preparation and NMR Properties of Tricarbonylchromium(0) Derivatives of Dithiacyclophanes. An Estimate of the Reduction in Ring Current of an Aromatic Ring on Tricarbonylchromium Complexation
Mitchell, Reginald H.,Vinod, Thottumkara K.,Bodwell, Graham J.,Bushnell, Gordon W.
, p. 5871 - 5879 (2007/10/02)
The tricarbonylchromium(0) complexes 9-16 of 2,11-dithiametacyclophane (1) its 6,15-dimethyl (2), syn- and anti-9,18-dimethyl (6,7), 5,7,14,16-tetramethyl (3), 9-fluoro (4), and 9,18-difluoro (5) derivatives, the complex 17 from 2,11-dithiaparacyclophane (8), and the bis complex 18 of 1 were prepared in 20-80percent yields by reaction of the cyclophane with either 1.6 or 6 equiv of Cr(CO)6 or Cr(CO)3(CH3CN)3.The IR, UV, and 1H, 19F, and 13C NMR spectra of the complexes are reported and discussed.Characteristically different spectra are obtained for the syn- and anti-cyclophanes, and some shifts are reversed in the thiacyclophanes from the cyclophanes themselves.Analysis of their NMR spectra indicates that the time-averaged conformation of the tricarbonylchromium umbrella is eclipsing the cyclophane bridges.The reduction of ring current of an arene on complexation with a tricarbonylchromium moiety is estimated at 40percent by analysis of the shift data of these cyclophanes.The complexation shifts in these dithiacyclophanes for protons is 1.6-2.0 ppm and for carbons is 32-39 ppm (tertiary carbons) and 26-29 ppm ( quaternary carbons).
