10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine

Modify Date: 2026-08-02 18:39:57

10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine Structure
10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine structure
 Common Name 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine
CAS Number 3159-07-7 Molecular Weight 227.282
Density 1.3±0.1 g/cm3 Boiling Point 309.2±12.0 °C at 760 mmHg
Molecular Formula C13H9NOS Melting Point 265ºC
MSDS N/A Flash Point 140.8±19.6 °C

 Names

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine
Synonym More Synonyms

 Chemical & Physical Properties

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density 1.3±0.1 g/cm3
Boiling Point 309.2±12.0 °C at 760 mmHg
Melting Point 265ºC
Molecular Formula C13H9NOS
Molecular Weight 227.282
Flash Point 140.8±19.6 °C
Exact Mass 227.040482
PSA 54.40000
LogP 2.97
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.667
InChIKey RTERDTBXBYNZIS-UHFFFAOYSA-N
SMILES O=C1Nc2ccccc2Sc2ccccc21
Storage condition Refrigerator

 MSDS

This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.

 Safety Information

This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.

Hazard Codes Xi
Risk Phrases R36/37/38
Safety Phrases 26-36/37/39
RIDADR NONH for all modes of transport
HS Code 2934999090

 Synthetic Route

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

 Customs

This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.

HS Code 2934999090
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Bioassay

View more

This table contains target information, in‑vitro & in‑vivo assay data for this compound.

Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
Name: NOVARTIS: Antimalarial liver stage activity measured as a greater than 50% reduction ...
Source: ChEMBL
Target: Plasmodium yoelii
External Id: CHEMBL1789905
Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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 Synonyms

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

Dibenzo[b,f][1,4]thiazepin-11(10H)-one
Dibenzo[b,f][1,4]thiazepinone
4]thiazepine
10,11-Dihydro-11-oxo dibenzo-1,4-thiazepine
MFCD00901197
Quetiapine Impurity 29

  | FAQ

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What are the upstream materials of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine?
A: Related upstream materials(CAS) of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine: 54920-98-8;13739-55-4;111974-73-3;7664-93-9;140425-65-6;100866-62-4;88-67-5;137-07-5;610-97-9;155882-74-9.
Q: What is the LogP of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine?
A: LogP of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine is 2.97.
Q: What are the downstream products of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine?
A: Related downstream products(CAS) of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine: 5747-48-8;67-63-0;329216-67-3;111974-69-7;13745-86-3;30690-43-8;753475-15-9.
Q: What English synonyms does 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine have?
A: English synonyms of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine: Dibenzo[b,f][1,4]thiazepin-11(10H)-one, Dibenzo[b,f][1,4]thiazepinone, 4]thiazepine, 10,11-Dihydro-11-oxo dibenzo-1,4-thiazepine, MFCD00901197, Quetiapine Impurity 29.
Q: What is the InChIKey of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine?
A: InChIKey of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine is RTERDTBXBYNZIS-UHFFFAOYSA-N.
Q: What is the boiling point of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine?
A: Boiling point of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine is 309.2±12.0 °C at 760 mmHg.
Q: What are the storage conditions for 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine?
A: Storage conditions for 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine: Refrigerator.
Q: What is the CAS number of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine?
A: CAS number of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine is 3159-07-7.
Q: What is the safety information for 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine?
A: Safety information for 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine: 26-36/37/39.
Q: What is the polar surface area (PSA) of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine?
A: Polar surface area (PSA) of 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine is 54.40000.

 factory

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Dayang Chem (Hangzhou) Co., Ltd.
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Chemsrc provides CAS#:3159-07-7 MSDS, density, melting point, boiling point, structure, etc. Its name is 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine>> amp version: 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine

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