Dibenzo[b,f][1,4]thiazepin-11(10H)-one
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![Dibenzo[b,f][1,4]thiazepin-11(10H)-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/5afb73165b1c4006bb93cb9bddeb4a4d.png "Dibenzo[b,f][1,4]thiazepin-11(10H)-one")
Dibenzo[b,f][1,4]thiazepin-11(10H)-one
structure -
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CAS No:
3159-07-7
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Formula:
C13H9NOS
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Chemical Name:
Dibenzo[b,f][1,4]thiazepin-11(10H)-one
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Synonyms:
Dibenzo[b,f][1,4]thiazepin-11(10H)-one;10,11-Dihydro-11-oxodibenz[b,f][1,4]thiazepine;NSC 653252;Dibenzo[b,f][1,4]thiazepine-11(10-H)-one;10,11-Dihydrodibenzo[b,f][1,4]thiazepin-11-one;dibenzo[b,f][1,4]thiazepin-11(10H)-one;10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine
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CAS No:
Dibenzo[b,f][1,4]thiazepin-11(10H)-one Basic Attributes
227.28
227.28
1592732-453-0
FL6FG1E3WF
653252
2934990002
Characteristics
54.4
2.9
Off-White Powder
1.292±0.06 g/cm3(Predicted)
257-259 °C
309.2ºC at 760 mmHg
140.8ºC
1.666
1.2 [ug/mL]
Refrigerator
Safety Information
36/37/38
26-36/37/39
P264, P270, P301+P312, P330, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 9 companies from 3 notifications to the ECHA C&L Inventory.|H315 (16.67%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:227.28
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:227.04048508
Monoisotopic Mass:227.04048508
Topological Polar Surface Area:54.4
Heavy Atom Count:16
Complexity:281
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Dibenzo[b,f][1,4]thiazepin-11(10H)-one
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