1-(6,11-Dihydrodibenzo(b,e)thiepin-11-yl)-3-(2-hydroxyethyl)urea

Base Information

Chemical Name:1-(6,11-Dihydrodibenzo(b,e)thiepin-11-yl)-3-(2-hydroxyethyl)urea
CAS No.:74797-31-2
Molecular Formula:C₁₇H₁₈N₂O₂S
Molecular Weight:314.408
Hs Code.:
DSSTox Substance ID:DTXSID90996322
Mol file:74797-31-2.mol

Synonyms:74797-31-2;BRN 4528502;VUFB-12436;1-(6,11-Dihydrodibenzo(b,e)thiepin-11-yl)-3-(2-hydroxyethyl)urea;Urea, N-(6,11-dihydrodibenzo(b,e)thiepin-11-yl)-N'-(2-hydroxyethyl)-;1-(6,11-DIHYDRODIBENZO[B,E]THIEPIN-11-YL)-3-(2-HYDROXYETHYL)UREA;C17H18N2O2S;DTXSID90996322;LS-159846;N-(6,11-Dihydrodibenzo[b,e]thiepin-11-yl)-N'-(2-hydroxyethyl)carbamimidic acid

Suppliers and Price of 1-(6,11-Dihydrodibenzo(b,e)thiepin-11-yl)-3-(2-hydroxyethyl)urea

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
1-(6,11-DIHYDRODIBENZO(B,E)THIEPIN-11-YL)-3-(2-HYDROXYETHYL)UREA 95.00%
5MG
$ 501.89

Total 3 raw suppliers

Chemical Property of 1-(6,11-Dihydrodibenzo(b,e)thiepin-11-yl)-3-(2-hydroxyethyl)urea

Chemical Property:

Vapor Pressure:6.83E-14mmHg at 25°C
Boiling Point:571.3°C at 760 mmHg
Flash Point:299.3°C
PSA：90.15000
Density:1.32g/cm³
LogP:3.26850
XLogP3:2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:314.10889899
Heavy Atom Count:22
Complexity:380

Purity/Quality:

99% ^*data from raw suppliers

1-(6,11-DIHYDRODIBENZO(B,E)THIEPIN-11-YL)-3-(2-HYDROXYETHYL)UREA 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C2=CC=CC=C2C(C3=CC=CC=C3S1)NC(=O)NCCO

Technology Process of 1-(6,11-Dihydrodibenzo(b,e)thiepin-11-yl)-3-(2-hydroxyethyl)urea

There total 2 articles about 1-(6,11-Dihydrodibenzo(b,e)thiepin-11-yl)-3-(2-hydroxyethyl)urea 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: 82.0%

: 74797-18-5
ethyl N-(6,11-dihydrodibenzothiepin-11-yl)carbamate

: 141-43-5
ethanolamine

: 74797-31-2
1-(6,11-dihydrodibenzothiepin-11-yl)-3-(2-hydroxyethyl)-urea

Guidance literature:: at 126 - 128 ℃; for 4h;
DOI:10.1135/cccc19800517

Reference yield:

: 1745-46-6
6,11-dihydrodibenzo[b,e]thiepin-11-ol

: 74797-31-2
1-(6,11-dihydrodibenzothiepin-11-yl)-3-(2-hydroxyethyl)-urea

Guidance literature:: Multi-step reaction with 2 steps

1: 98 percent / 4-toluenesulfonic acid / acetic acid / 1) 37 deg C, 6h; 2) room temp., overnight

2: 82 percent / 4 h / 126 - 128 °C

With toluene-4-sulfonic acid; In acetic acid;
DOI:10.1135/cccc19800517