4-(2-Phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)phenol

Base Information

Chemical Name:4-(2-Phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)phenol
CAS No.:64820-41-3
Molecular Formula:C21H17NOS
Molecular Weight:331.438
Hs Code.:
DSSTox Substance ID:DTXSID70421405
Mol file:64820-41-3.mol

Synonyms:64820-41-3;4-(2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)phenol;4-(2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene)cyclohexa-2,5-dien-1-one;Phenol, 4-(2,3-dihydro-2-phenyl-1,5-benzothiazepin-4-yl)-;DTXSID70421405;TYAICLLUTKIPRK-UHFFFAOYSA-N;STL227414;AKOS000267194;AKOS016038943;AJ-091/33281007;Z56842327;F1061-0003;4-(2-phenyl-2,3-dihydrobenzo[b][1,4]thiazepin-4-yl)phenol

Suppliers and Price of 4-(2-Phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)phenol

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of 4-(2-Phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)phenol

Chemical Property:

PSA：54.40000
LogP:5.42280
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:331.10308534
Heavy Atom Count:24
Complexity:437

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C(SC2=CC=CC=C2N=C1C3=CC=C(C=C3)O)C4=CC=CC=C4

Technology Process of 4-(2-Phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)phenol

There total 5 articles about 4-(2-Phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl)phenol 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: 87.0%

: 2657-25-2
(E)-1-(4-hydroxyphenyl)-3-phenylprop-2-en-1-one

: 137-07-5
2-amino-benzenethiol

: 64820-41-3
4-(2-phenyl-2,3-dihydrobenzo[b][1,4]thiazepine-4-yl)phenol

Guidance literature:: magnesium(II) perchlorate; In 1,2-dichloro-ethane; for 1h; Heating;
DOI:10.1055/s-2007-965892

Reference yield: 81.0%

: 2657-25-2,38239-52-0,102692-58-0
4'-hydroxychalcone

: 137-07-5
2-amino-benzenethiol

: 64820-41-3
4-(2-phenyl-2,3-dihydrobenzo[b][1,4]thiazepine-4-yl)phenol

Guidance literature:: With 1,3,5-trichloro-2,4,6-triazine; at 80 ℃; for 5h; Neat (no solvent);
DOI:10.1080/17415993.2011.572971

Reference yield:

: 100-52-7
benzaldehyde

: 64820-41-3
4-(2-phenyl-2,3-dihydrobenzo[b][1,4]thiazepine-4-yl)phenol

Guidance literature:: Multi-step reaction with 2 steps

1: sodium hydroxide / ethanol / 20 °C

2: hydrogenchloride; sodium sulfate / ethanol; water / Reflux

With hydrogenchloride; sodium sulfate; sodium hydroxide; In ethanol; water;