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(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol

CAS No.
1454847-96-1
Chemical Name:
(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol
Synonyms
EOS-60623;-1-(5-fluoro-2-iodophenyl)ethan-1-ol;(S)-1-(2-Iodo-5-fluorophenyl)-ethanol;(1S)-1-(5-fluoro-2-iodophenyl)ethanol;(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol;(S)-1-(5-fluoro-2-iodophenyl)ehtan-1-ol;(1S)-1-(5-FLUORO-2-IODOPHENYL)ETHAN-1-OL;(S)-5-Fluoro-2-iodo-alpha-methylbenzyl Alcohol;(S)-5-Fluoro-2-iodo-alpha-methylbenzenemethanol;Benzenemethanol, 5-fluoro-2-iodo-α-methyl-, (αS)-
CBNumber:
CB53142393
Molecular Formula:
C8H8FIO
Molecular Weight:
266.05
MDL Number:
MFCD30803240
MOL File:
1454847-96-1.mol
Last updated:2024-04-17 13:31:18

(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol Properties

Boiling point 275.7±30.0 °C(Predicted)
Density 1.812±0.06 g/cm3(Predicted)
pka 13.80±0.20(Predicted)

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P280-P301+P312-P302+P352-P305+P351+P338

(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol price

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
AK Scientific CS-0078600 (S)-1-(5-Fluoro-2-iodophenyl)ethan-1-ol 1454847-96-1 5g $105 2021-12-16 Buy
Product number Packaging Price Buy
CS-0078600 5g $105 Buy

(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol Chemical Properties,Uses,Production

Physical Form

Solid or liquid

Uses

(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol is an intermediate of Lorlatinib, which is an orally administered inhibitor of ALK and ROS1, two enzymes that play a role in the development of cancer.

Synthesis

(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol is synthesised using 5'-Fluoro-2'-iodoacetophenone as a raw material by chemical reaction. The specific synthesis steps are as follows:
A solution of (-)-DIPCI (57.1 g, 178 mmol) in THF (100 ml) was cooled to -20 to -30 C. A solution of compound 1 (31 .3 g, 1 19 mmol) in THF (100 ml) was then added dropwise, via addition funnel (30 min addition). The reaction was left to warm up to RT. After 2 h, the reaction was cooled to -30 C and another portion of (-)-DIPCI (38.0 g, 1 19 mmol) was added. After 30 min, the reaction was allowed to warm to RT and after 1 h, the solvents were removed in vacuo and the residue re-dissolved in MTBE (200 ml). A solution of diethanolamine (31 g, 296 mmol) in ethanol/THF (15 ml/30 ml) was added via addition funnel, to the reaction mixture under an ice bath. The formation of a white precipitate was observed. The suspension was heated at reflux for 2 hours then cooled to room temperature, filtered and the mother liquids concentrated in vacuo. The residue was suspended in heptane/EtOAc (7:3, 200 ml) and again filtered. This procedure was repeated until no more solids could be observed after the liquids were concentrated. The final yellow oil was purified by column chromatography (eluent: cyclohexane/EtOAc- 99:1 to 96:4). The resulting colorless oil was further purified by recrystallisation from heptanes, to give alcohol compound 2 (25 g, 80% yield, 99% purity and 96% ee) as white crystals. 1H NMR (400 MHz, CDCI3) delta 7.73 (dd, 1 H), 7.32 (dd, 1 H), 6.74 (ddd, 1 H), 4.99 - 5.04 (m, 1 H), 2.01 (d, 1 H), 1.44 (d, 3 H). LCMS-ES: No ionization, Purity 99%. Chiral GC (column CP-Chirasil-DexnCB): 96% ee; Rt (minor) 17.7 minutes and Rt (major) 19.4 minutes.
(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol synthesis

(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol Preparation Products And Raw materials

Raw materials

Preparation Products

Global( 121)Suppliers
Supplier Tel Email Country ProdList Advantage
SyncoZymes (Shanghai) Co., Ltd.,
+86-021-68187180-811 +86-13681683526 lchen@syncozymes.com China 188 58
Henan Fengda Chemical Co., Ltd
+86-371-86557731 +86-13613820652 info@fdachem.com China 20287 58
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SHANGHAI T&W PHARMACEUTICAL CO., LTD.
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+8615990591583 15990591583 CHINA 2029 58

View Lastest Price from (S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol pictures 2024-11-21 (S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol
1454847-96-1
US $0.00-0.00 / kg 1kg 98% 1 ton Nanjing Fred Technology Co., Ltd
(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol pictures 2024-04-09 (S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol
1454847-96-1
US $5.00-0.10 / KG 1KG 98% g-kg-tons, free sample is available Henan Fengda Chemical Co., Ltd
(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol pictures 2022-10-09 (S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol
1454847-96-1
US $0.00-0.00 / KG 1KG 98% 1Ton Henan Aochuang Chemical Co.,Ltd.
(S)-1-(5-fluoro-2-iodophenyl)ethan-1-ol (1S)-1-(5-FLUORO-2-IODOPHENYL)ETHAN-1-OL EOS-60623 Benzenemethanol, 5-fluoro-2-iodo-α-methyl-, (αS)- (S)-1-(2-Iodo-5-fluorophenyl)-ethanol -1-(5-fluoro-2-iodophenyl)ethan-1-ol (1S)-1-(5-fluoro-2-iodophenyl)ethanol (S)-5-Fluoro-2-iodo-alpha-methylbenzyl Alcohol (S)-5-Fluoro-2-iodo-alpha-methylbenzenemethanol (S)-1-(5-fluoro-2-iodophenyl)ehtan-1-ol 1454847-96-1