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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

Dibenzo[b,e]thiepin-11(6H)-one

O=C1c2ccccc2SCc2c1cccc2 Request for Quotation
Chemical Name: Dibenzo[b,e]thiepin-11(6H)-one
CAS Number: 1531-77-7
Product Number: AG0034P8(AGN-PC-0JLB5T)
Synonyms:
MDL No:
Molecular Formula: C14H10OS
Molecular Weight: 226.2936

Identification/Properties

Properties
MP:
86-88 °C(lit.)
BP:
405.4°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.5700 (estimate)
Computed Properties
Molecular Weight:
226.293g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
226.045g/mol
Monoisotopic Mass:
226.045g/mol
Topological Polar Surface Area:
42.4A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
276
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

NMR Spectrum

Other Analytical Data

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Chemical Structure


6,11-Dihydrodibenzo[b,e]thiepin-11-one is a versatile compound commonly utilized in chemical synthesis for its unique reactivity and structural features. As a heterocyclic molecule, this compound serves as a valuable building block in the development of various pharmaceuticals, agrochemicals, and materials due to its ability to participate in diverse types of chemical transformations.In organic synthesis, 6,11-Dihydrodibenzo[b,e]thiepin-11-one acts as a key intermediate in the preparation of complex organic molecules by serving as a precursor for the introduction of functional groups or further modifications. Its distinct structure enables the formation of new bonds through substitution, addition, and cyclization reactions, making it an essential component in the creation of novel compounds with specific properties and activities.Moreover, the unique three-dimensional arrangement of atoms in 6,11-Dihydrodibenzo[b,e]thiepin-11-one allows for the construction of molecular scaffolds with desirable stereochemical characteristics, facilitating the synthesis of chiral molecules and pharmaceutical intermediates. Its strategic placement of electron-rich and electron-deficient regions makes it a valuable tool for designing molecular structures with tailored reactivity and selectivity.Overall, the application of 6,11-Dihydrodibenzo[b,e]thiepin-11-one in chemical synthesis showcases its significance in enabling the construction of diverse molecular architectures with potential applications in various fields of chemistry and beyond.