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401-76-3

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401-76-3 Usage

General Description

2-(3-fluorophenyl)propan-2-ol, also known as 3-fluoro-alpha-methylbenzyl alcohol, is a chemical compound with the molecular formula C9H11FO. It is a secondary alcohol that consists of a fluorophenyl group attached to a propan-2-ol moiety. 2-(3-fluorophenyl)propan-2-ol is used in organic synthesis and pharmaceutical research as a chiral building block for the preparation of various pharmaceutical drugs and biologically active compounds. It is also used as a reagent in the synthesis of complex organic molecules and can be utilized in the development of new technologies and materials. 2-(3-fluorophenyl)propan-2-ol is a valuable chemical intermediate with potential applications in a wide range of industries.

Check Digit Verification of cas no

The CAS Registry Mumber 401-76-3 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 4,0 and 1 respectively; the second part has 2 digits, 7 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 401-76:
(5*4)+(4*0)+(3*1)+(2*7)+(1*6)=43
43 % 10 = 3
So 401-76-3 is a valid CAS Registry Number.
InChI:InChI=1/C9H11FO/c1-9(2,11)7-4-3-5-8(10)6-7/h3-6,11H,1-2H3

401-76-3SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(3-fluorophenyl)propan-2-ol

1.2 Other means of identification

Product number -
Other names <3-Fluor-phenyl>-dimethylcarbinol

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:401-76-3 SDS

401-76-3Relevant articles and documents

HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME

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Paragraph 0479-0481, (2021/11/20)

Provided are a heterocyclic compound represented by Formula 1 and an organic light-emitting device including the same. The organic light-emitting device includes: a first electrode; a second electrode facing the first electrode; and an organic layer betwe

Synthesis of 4H-1,3-Benzoxazines via Metal- and Oxidizing Reagent-Free Aromatic C-H Oxygenation

Xu, Fan,Qian, Xiang-Yang,Li, Yan-Jie,Xu, Hai-Chao

supporting information, p. 6332 - 6335 (2017/12/08)

An unprecedented electrochemical aromatic C-H oxygenation reaction for the synthesis of 4H-1,3-benzoxazines from easily available N-benzylamides is reported. These oxidative cyclization reactions proceed in a transition metal- and oxidizing reagent-free fashion and produce H2 as only theoretical byproduct. Adapting the C-H oxygenation reaction in an electrochemical microreactor has been demonstrated.

Carbocation-forming reactions in ionic liquids

Creary, Xavier,Willis, Elizabeth D.,Gagnon, Madeleine

, p. 18114 - 18120 (2007/10/03)

A number of trifluoroacetates, mesylates, and triflates have been studied in ionic liquids. Several lines of evidence indicate that all of these substrates react via ionization to give carbocationic intermediates. For example, cumyl trifluoroacetates give mainly the elimination products, but the Hammett ρ+ value of -3.74 is consistent with a carbocationic process. The analogous exo-2-phenyl-endo-3-deutero-endo-bicyclo-[2.2.1]hept-2-yl trifluoroacetate gives an elimination where loss of the exo-hydrogen occurs from a cationic intermediate. 1-Adamantyl mesylate and 2-adamantyl triflate react to give simple substitution products derived from capture of 1- and 2-adamantyl carbocations by the residual water in the ionic liquid. The triflate derivative of pivaloin, trans-2-phenylcyclopropylcarbinyl mesylate, 2,2-dimethoxycyclobutyl triflate, the mesylate derivative of diethyl (phenylhydroxymethyl)-thiophosphonate, and Z-1-phenyl-5-trimethylsilyl-3-penten- 1-yl trifluoroacetate all give products derived carbocation rearrangements (kΔ processes), anti-7-Norbornenyl mesylate gives products with complete retention of configuration, indicative of involvement of the delocalized 7-norbornenyl cation. 1,6-Methano[10]annulen-11-yl triflate reacts in [BMIM][NTf2] to give 1,6-methano[10]annulen-11-ol, along with naphthalene, an oxidized product derived from loss of trifluoromethanesulfinate ion. Analogous loss of CF3SO2- can be seen in reaction of PhCH(CF3)OTf. Ionic liquids are therefore viable solvents for formation of carbocationic intermediates via kc and k Δ processes.

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