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42399-40-6

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42399-40-6 Structure

42399-40-6 Structure
IdentificationBack Directory
[Name]

Deacetyldiltiazem
[CAS]

42399-40-6
[Synonyms]

Deacetyldiltiazem
Desacetyl Diltiazem
Deacetyl-d-diltiazem
DiltiazeM EP IMpurity F
d-cis-Desacetyldiltiazem
3-Hydroxy-5-[2-(dimethylamino)ethyl]-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
5-[2-(Dimethylamino)ethyl]-3-hydroxy-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
(2S)-5-[2-(Dimethylamino)ethyl]-2,3-dihydro-3β-hydroxy-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
(2S)-5-[2-(Dimethylamino)ethyl]-2,3-dihydro-3β-hydroxy-2β-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
(2S-cis)-5-[(Dimethylamino)ethyl]-2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
(2S)-2-(4-Methoxyphenyl)-3β-hydroxy-5-[2-(dimethylamino)ethyl]-2,3-dihydro-1,5-benzothiazepine-4(5H)-one
(2S-cis)-5-(2-(Dimethylamino)ethyl)-2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
(2S-cis)-5-[2-(dimethylamino)ethyl]-2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
(2S,3S)-2,3-Dihydro-2-(4-methoxyphenyl)-3-hydroxy-5-[2-(dimethylamino)ethyl]-1,5-benzothiazepine-4(5H)-one
[2S,(+)]-3β-Hydroxy-5-[2-(dimethylamino)ethyl]-2,3-dihydro-2β-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
(3S,4S)-6-(2-dimethylaminoethyl)-4-hydroxy-3-(4-methoxyphenyl)-2-thia-6-azabicyclo[5.4.0]undeca-7,9,11-trien-5-one
[EINECS(EC#)]

255-795-9
[Molecular Formula]

C20H24N2O3S
[MDL Number]

MFCD00870735
[MOL File]

42399-40-6.mol
[Molecular Weight]

372.49
Chemical PropertiesBack Directory
[Appearance]

Off-White to Pale Yellow Solid
[Melting point ]

86-87 °C
[Boiling point ]

596.8±50.0 °C(Predicted)
[density ]

1.225±0.06 g/cm3(Predicted)
[storage temp. ]

Hygroscopic, Refrigerator, Under Inert Atmosphere
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

11.96±0.40(Predicted)
[color ]

White to Brown
[Stability:]

Hygroscopic
[CAS DataBase Reference]

42399-40-6
[EPA Substance Registry System]

1,5-Benzothiazepin-4(5H)-one, 5-[2-(dimethylamino)ethyl]-2,3-dihydro-3-hydroxy-2-(4-methoxyphenyl)-, (2S,3S)- (42399-40-6)
Hazard InformationBack Directory
[Chemical Properties]

Off-White to Pale Yellow Solid
[Uses]

A metabolite of Diltiazem (D460620).
[Definition]

ChEBI: Deacetyldiltiazem is a benzothiazepine.
Safety DataBack Directory
[REACH Registrations]

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