11-Chlorodibenzo[b,f][1,4]thiazepine

CAS No. 13745-86-3

Formula: C13H8ClNS
Basic Info

A metabolite of Quetiapine.

Formula
C13H8ClNS
Molecular Weight
245.727
Exact Mass
245.007
LogP
3.9039
PSA
37.66
Synonyms

6-chlorobenzo[b][1,4]benzothiazepine

11-Chloro-dibenzo[b,f][1,4]thiazepine

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Properties
Appearance & Physical State
Pale-Yellow Solid
Density
1.329g/cm3
Boiling Point
384.595ºC at 760 mmHg
Flash Point
186.397ºC
Refractive Index
1.685
Vapor Pressure
0mmHg at 25°C
Safety Info
HS Code
2934999090
Spectrum
NMR Spectrum 1H NMR : Predict
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Synthesis Route
1.Synthesis Route
2.Synthesis Route
3.Synthesis Route

Related Compound Information

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