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[(3s,5r)-5-(2,4-Difluorophenyl)-5-(1,2,4-Triazol-1-Ylmethyl)Oxolan-3-Yl]Methyl 4-Methylbenzenesulfonate
[(3S,5R)-5-(2,4-Difluorophenyl)-5-(1,2,4-Triazol-1-Ylmethyl)Oxolan-3-Yl]Methyl 4-Methylbenzenesulfonate / CAS : 149809-43-8
| Appearance | white solid | UN | - |
| HS | 29349990 | DG Class | - |
| Synonyms | 6-Methoxyaromadendrin 3-O-Acetate; Posaconazole Impurity 53; ((3S,5R)-5-((1H-1,2,4-Triazol-1-Yl)Methyl)-5-(2,4-Difluorophenyl)-Tetrahydrofuran-3-Yl)Methyl 4-Methylbenzenesulfonate; Posaconazole Intermediates; 2,5-Anhydro-1,3,4-Trideoxy-2-C-(2,4-Difluorophenyl)-4-[[[(4-Methylphenyl)Sulfonyl]Oxy]Methyl]-1-(1H-1,2,4-Triazol-1-Yl)-D-Threo-Pentitol; (5R-Cis)-Toluene-4-Sulfonic Acid 5-(2,4-Difluorophenyl)-5-(1H-1,2,4-Triazol-1-Yl)Methyltetrahydrofuran-3-Ylmethyl Ester- (Poa); Toluene-4-Sulfonica Cid 5-(2,4-Difluoro-Phenyl)-5-[1,2,4]Triazol-1-Ylmethyl-Tetrahydro-Furan-3-Ylmethyl Ester; ((3R,5R)-5-((1H-1,2,4-Triazol-1-Yl)Methyl)-5-(2,4-Difluorophenyl)Tetrahydrofuran-3-Yl)Methyl 4-Methylbenzenesulfonate | ||
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Overview
Properties
Summary
Formula
C21H21F2N3O4S
Molecular Mass
449.47100
Exact Mass
449.12200
PSA
91.69000
Logp
4.28300
IUPAC
[(3S,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methyl 4-methylbenzenesulfonate
SMILES
CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2C[C@@](OC2)(CN3C=NC=N3)C4=C(C=C(C=C4)F)F
Attribute classification
Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates
Chemical and Physical Properties
Melting Point
100-102 °C
Density
1.4 g/cm3
Boiling Point
608.1 ºC
Flash Point
321.6 ºC
Appearance
white solid
Acidity and Basicity
alkalinity
Export information
HS Code
29349990
Export Rebate
10%
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