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ChemicalBook--->CAS DataBase List--->915095-94-2

915095-94-2

915095-94-2 Structure

915095-94-2 Structure
IdentificationBack Directory
[Name]

(3S)-3-[4-[(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydro-furan
[CAS]

915095-94-2
[Synonyms]

]phenoxy}oxoL
oro-5-iodophenyL
(3S)-3-{4-[(2-chL
Englitin Impurity 28
EMpagliflozin iMpurity C
Empagliflozin Impurity 110
Empagliflozin Intermediate1
(3S)-3-[4-[(2-Chloro-5-iodophenyl) methyl] phenc
1-chloro-2-(4-(cyclopentyloxy)benzyl)-4-iodobenzene
(3S)-3-{4-[(2-chloro-5-iodophenyl)methyl]phenoxy}oxolane
(S)-3-(4-(2-chloro-5-iodobenzyl)phenoxy)-tetrahydrofuran
(S)-3-(4-(2-chloro-5-fluorobenzyl)phenoxy)-tetrahydrofuran
(3S)-3-[4-(2-chloro-5-iodobenzyl)-phenoxy]-tetrahydrofuran
3-[4-[(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydro-furan
(3S-3-(4)Chloro-5-Iodophenyl)Methyl)Phenoxy)Tetrahydro-Furan
(3S)-3-[4-[(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydro-...
(S)-4-iodo-1-chloro-2-(4-tetrahydrofuran-3-yloxy-benzyl)-benzene
(3S)-3-[4-[(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydro-furan
(3S)-3-[4-4(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydro-furan
(3S)-3-[4-[(5-Iodo-2- Chlorophenyl) Methyl] Phenoxy] Tetrahydrofuran
Furan, 3-[4-[(2-chloro-5-iodophenyl)methyl]phenoxy]tetrahydro-, (3S)-
(3S)-3-[4-[(2-CHLORO-5-IODOPHENYL)METHYL]PHENOXY]TETRAHYDRO-FURAN 915095-94-2
(3S)-3-[4-[(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydro-furan(For export only)
(3S)-3-[4-[(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydro-furan ISO 9001:2015 REACH
Empagliflozin Intermediate/ (3S)-3-[4-[(2-Chloro-5-Iodophenyl)Methyl]Phenoxy]Tetrahydro-Furan
[EINECS(EC#)]

619-599-0
[Molecular Formula]

C17H16ClFO2
[MDL Number]

MFCD28098707
[MOL File]

915095-94-2.mol
[Molecular Weight]

306.759
Questions And AnswerBack Directory
[Physical Form]

Solid
[Uses]

(3S)-3-[4-[(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydrofuran(915095-94-2) can be used as reactant/reagent in preparation of C-?aryl D-?glurofuranoside compounds useful as reference compounds in the quality control of gliflozin type medicine.
Chemical PropertiesBack Directory
[Boiling point ]

476.0±45.0 °C(Predicted)
[density ]

1.578±0.06 g/cm3 (20 ºC 760 Torr)
[storage temp. ]

Keep in dark place,Sealed in dry,2-8°C
[solubility ]

DMSO, Methanol (Slightly, Sonicated)
[form ]

Solid
[color ]

White to Off-White
[InChI]

InChI=1S/C17H16ClIO2/c18-17-6-3-14(19)10-13(17)9-12-1-4-15(5-2-12)21-16-7-8-20-11-16/h1-6,10,16H,7-9,11H2/t16-/m0/s1
[InChIKey]

YLUHNGIWRCCQMQ-INIZCTEOSA-N
[SMILES]

O1CC[C@H](OC2=CC=C(CC3=CC(I)=CC=C3Cl)C=C2)C1
[CAS DataBase Reference]

915095-94-2
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Hazard InformationBack Directory
[Description]

(S)-3-(4-(2-Chloro-5-iodobenzyl)phenoxy)tetrahydrofuran is a pharmaceutical intermediate compound that is used in the preparation of empagliflozin. Empagliflozin is an inhibitor of sodium-glucose co-transporter protein-2 (SGLT2), which is used in the treatment of type 2 diabetes.
[Preparation]

0.5 mol of raw material and 0.6 mol of aluminum chloride were added to 2 mol of methanol at a temperature of 20° C, and then 0.6 mol of triethylsilane was added to the mixed solution. The mixture was stirred at 25° C for 1 h.The conversion is determined by HPLC analysis. After the reaction is complete, it is extracted and distilled under reduced pressure.Finally, (3S)-3-[4-[(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydro-furan was obtained through purification.  
(3S)-3-[4-[(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydro-furan
[References]

[1] Hu, S., et al. Design, synthesis and anticancer activities of halogenated Phenstatin analogs as microtubule destabilizing agent. Med Chem Res 28, 465–472 (2019).
Spectrum DetailBack Directory
[Spectrum Detail]

(3S)-3-[4-[(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydro-furan(915095-94-2)1HNMR
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