(3S)-3-[4-[(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydrofuran

For Research Use Only.
Category
Impurities
Cat.No.
NP3669
CAS
915095-94-2
Product Name
(3S)-3-[4-[(2-Chloro-5-iodophenyl)methyl]phenoxy]tetrahydrofuran
Structure
Structure

Product Details

Description
An impurity of Empagliflozin, a medication indicated for type 2 diabetes treatment.
Synonyms
Furan, 3-[4-[(2-chloro-5-iodophenyl)methyl]phenoxy]tetrahydro-, (3S)-; (S)-3-(4-(2-Chloro-5-iodobenzyl)phenoxy)tetrahydrofuran; Empagliflozin Impurity 11
IUPAC Name
(3S)-3-[4-[(2-chloro-5-iodophenyl)methyl]phenoxy]oxolane
Molecular Weight
414.67
Molecular Formula
C17H16ClIO2
Canonical SMILES
C1COC[C@H]1OC2=CC=C(C=C2)CC3=C(C=CC(=C3)I)Cl
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
Boiling Point
476.0±45.0 °C at 760 mmHg
Melting Point
60-62 °C
Purity
≥95%
Density
1.578±0.06 g/cm3
Solubility
Soluble in DMSO, Methanol (Slightly, Ultrasonic)
Appearance
White to off-white solid
Storage
Store at 2-8 °C, protect from light
MDL
MFCD28098707
Packaging
100 mg
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