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64546-10-7

64546-10-7 Structure

64546-10-7 Structure
IdentificationBack Directory
[Name]

alpha-hydroxyetizolam
[CAS]

64546-10-7
[Synonyms]

α-hydroxy Etizolam
Etizolam Impurity 1
alpha-hydroxyetizolam
YRJXUAYHZCDGDO-UHFFFAOYSA-N
4-(2-Chlorophenyl)-α,9-dimethyl-6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-2-methanol
4-(2-Chlorophenyl)-α,9-dimethyl-6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-2-methanol
6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine-2-methanol, 4-(2-chlorophenyl)-α,9-dimethyl-
[Molecular Formula]

C17H15ClN4OS
[MOL File]

64546-10-7.mol
[Molecular Weight]

358.85
Chemical PropertiesBack Directory
[Boiling point ]

595.3±60.0 °C(Predicted)
[density ]

1.51±0.1 g/cm3(Predicted)
[storage temp. ]

-20°C
[solubility ]

DMF: 15 mg/mL; DMSO: 15 mg/mL; Ethanol: 15 mg/mL; PBS (pH 7.2): 0.5 mg/mL
[form ]

A solid
[pka]

13.52±0.20(Predicted)
[Major Application]

clinical testing
[InChI]

1S/C17H15ClN4OS/c1-9(23)14-7-11-8-19-15(12-5-3-4-6-13(12)18)16-21-20-10(2)22(16)17(11)24-14/h3-9,15,23H,1-2H3
[InChIKey]

BTGCWXDWJAGZML-UHFFFAOYSA-N
[SMILES]

[s]1c2c(cc1C(O)C)C=NC(c4[n]2c(nn4)C)c3c(cccc3)Cl
Safety DataBack Directory
[WGK Germany ]

WGK 2
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Acute Tox. 3 Dermal
Acute Tox. 3 Inhalation
Acute Tox. 3 Oral
Flam. Liq. 2
STOT SE 1
Hazard InformationBack Directory
[Uses]

alpha-hydroxyetizolam is a metabolite of Brotizolam (B689280). A hypnotic and a sedative, also used in veterinary medicine as an appetite stimulant.
64546-10-7 suppliers list
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