cis-[2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl-4-methylbenzenesulphonate CAS 134071-44-6

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• Prop­er­ties
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Iden­ti­fi­ca­tion

CAS Number

134071-44-6

Name

cis-[2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl-4-methylbenzenesulphonate ; Cis Tosylate 

Syn­onyms

[(2R,4R)-2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl 4-methyl­ben­zene­­sul­­fonate [ACD/IUPAC Name]
[(2R,4R)-2-(2,4-Dichlorphenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl-4-methylbenzolsulfonat [Ger­man] [ACD/IUPAC Name]
1,3-Dioxolane-4-methanol, 2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-, 4-methyl­ben­zene­­sul­­fonate (ester), (2R,4R)- [ACD/​Index Name]
134071-44-6 [RN]
2-(2,4-DICHLOROPHENYL)-2-(1H-IMI­DA­ZOL-1-YLMETHYL)-1,3-DIOX­OLAN-4-YL)METHYL 4-METHYL­BEN­ZENE­­SUL­­FONATE
4-Méthyl­ben­zè­ne­­sul­­fonate de [(2R,4R)-2-(2,4-dichlorophényl)-2-(1H-imidazol-1-ylméthyl)-1,3-dioxolan-4-yl]méthyle [French] [ACD/IUPAC Name]
((2R,4R)-2-((1H-imidazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methyl 4-methyl­ben­zene­­sul­­fonate
((2R,4R)-rel-2-((1H-Imidazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methyl 4-methyl­ben­zene­­sul­­fonate
(cis-2-((1H-Imidazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methyl 4-methyl­ben­zene­­sul­­fonate
[(2R,4R)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl 4-methyl­ben­zene­­sul­­fonate
[(2RS,4SR)-2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl 4-Methyl­ben­zene­­sul­­fonate
1610851-15-4 [RN]
4-methyl­ben­zene­­sul­­fon­ic acid [(2R,4R)-2-(2,4-dichlorophenyl)-2-(1-imidazolylmethyl)-1,3-dioxolan-4-yl]methyl ester
4-methyl­ben­zene­­sul­­fon­ic acid [(2R,4R)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl ester
MFCD00800225 [MDL num­ber]
MFCD07367827 [MDL num­ber]
MFCD23843811 [MDL number]

SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC[C@H]2CO[C@](O2)(CN3C=CN=C3)C4=C(C=C(C=C4)Cl)Cl

Std­InChI

InChI=1S/C21H20Cl2N2O5S/c1-15-2-5-18(6-3-15)31(26,27)29-12-17-11-28-21(30-17,13-25-9-8-24-14-25)19-7-4-16(22)10-20(19)23/h2-10,14,17H,11-13H2,1H3/t17-,21+/m1/s1

Std­InChIKey

WAXNIY­HZFWRPGS-UTKZUKDT­SA-N

Mol­e­c­u­lar Formula

C₂₁H₂₀Cl₂N₂O₅S

Mol­e­c­u­lar Weight

483.365

MDL Number

MFCD00800225 ; MFCD07367827 ; MFCD23843811

Prop­er­ties

Appear­ance

Pow­der

Safe­ty Data

WGK Germany

3

Spec­i­fi­ca­tions and Oth­er Infor­ma­tion of Our cis-[2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl-4-methylbenzenesulphonate CAS 134071-44-6

Assay

98%

Known Appli­ca­tion

Often used as an inter­me­di­ate for ketoconazole.

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