N-Methyl-6,6-dioxido-5,7-dihydrodibenzo(c,e)thiepin-5-carboxamide

Base Information

Chemical Name:N-Methyl-6,6-dioxido-5,7-dihydrodibenzo(c,e)thiepin-5-carboxamide
CAS No.:110129-24-3
Molecular Formula:C16H15 N O3 S
Molecular Weight:301.366
Hs Code.:
DSSTox Substance ID:DTXSID20911503
Mol file:110129-24-3.mol

Synonyms:110129-24-3;BRN 4501361;N-Methyl-6,6-dioxido-5,7-dihydrodibenzo(c,e)thiepin-5-carboxamide;N-methyl-6,6-dioxo-5,7-dihydrobenzo[d][2]benzothiepine-5-carboxamide;Dibenzo(c,e)thiepin-5-carboxamide, 5,7-dihydro-N-methyl-, 6,6-dioxide;Oprea1_211296;DTXSID20911503;MSOSRGKXOUYZDF-UHFFFAOYSA-N;LS-61375;N-Methyl-6,6-dioxo-6,7-dihydro-5H-6lambda~6~-dibenzo[c,e]thiepine-5-carboximidic acid

Suppliers and Price of N-Methyl-6,6-dioxido-5,7-dihydrodibenzo(c,e)thiepin-5-carboxamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Total 0 raw suppliers

Chemical Property of N-Methyl-6,6-dioxido-5,7-dihydrodibenzo(c,e)thiepin-5-carboxamide

Chemical Property:

Vapor Pressure:1.75E-17mmHg at 25°C
Boiling Point:663.7°C at 760 mmHg
Flash Point:355.2°C
Density:1.307g/cm³
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:301.07726451
Heavy Atom Count:21
Complexity:496

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CNC(=O)C1C2=CC=CC=C2C3=CC=CC=C3CS1(=O)=O

Technology Process of N-Methyl-6,6-dioxido-5,7-dihydrodibenzo(c,e)thiepin-5-carboxamide

There total 7 articles about N-Methyl-6,6-dioxido-5,7-dihydrodibenzo(c,e)thiepin-5-carboxamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 110129-22-1
6,6-dioxido-5,7-dihydrodibenzothiepin-5-carboxylic acid

: 74-89-5
methylamine

: 85-01-8
phenanthrene

: 110129-24-3
N-methyl-6,6-dioxido-5,7-dihydrodibenzothiepin-5-carboxamide

: 110129-35-6
N,N'-dimethyl-6,6-dioxido-5,7-dihydrodibenzothiepin-5,7-dicarboxamide

Guidance literature:: With thionyl chloride; Yield given. Multistep reaction. Yields of byproduct given; 1) benzene, 3 h, reflux, 2) 2 h;

Reference yield:

: 863305-32-2
diphenic acid

: 110129-24-3
N-methyl-6,6-dioxido-5,7-dihydrodibenzothiepin-5-carboxamide

Guidance literature:: Multi-step reaction with 6 steps

1: 73 percent / NaBH₄, BF₃*O(C₂H₅)2 / tetrahydrofuran

2: 98 percent / HBr / H₂O; H₂SO₄ / Heating

3: 84 percent / Na₂S*9H₂O / H₂O; methanol / Heating

4: 89 percent / 30 percent H₂O₂ / acetic acid; H₂O / 1.5 h / Heating

5: 1) n-butyllithium / 1) benzene, ether, hexane, tetrahydrofuran,

6: 1) SOCl₂ / 1) benzene, 3 h, reflux, 2) 2 h

With sodium sulfide; sodium tetrahydroborate; n-butyllithium; thionyl chloride; boron trifluoride diethyl etherate; hydrogen bromide; dihydrogen peroxide; In tetrahydrofuran; methanol; sulfuric acid; water; acetic acid;

Reference yield:

: 6672-64-6
5,7-dihydrodibenzo[c,e]thiepine

: 110129-24-3
N-methyl-6,6-dioxido-5,7-dihydrodibenzothiepin-5-carboxamide

Guidance literature:: Multi-step reaction with 3 steps

1: 89 percent / 30 percent H₂O₂ / acetic acid; H₂O / 1.5 h / Heating

2: 1) n-butyllithium / 1) benzene, ether, hexane, tetrahydrofuran,

3: 1) SOCl₂ / 1) benzene, 3 h, reflux, 2) 2 h

With n-butyllithium; thionyl chloride; dihydrogen peroxide; In water; acetic acid;