1H-1,5-Benzodiazepine-2-thione, 2,3,4,5-tetrahydro-4-methyl-

Base Information

Chemical Name:1H-1,5-Benzodiazepine-2-thione, 2,3,4,5-tetrahydro-4-methyl-
CAS No.:74389-71-2
Molecular Formula:C₁₀H₁₂N₂S
Molecular Weight:192.285
Hs Code.:
DSSTox Substance ID:DTXSID00995902
Nikkaji Number:J69.303K

Synonyms:BRN 0784137;4-Methyl-1H-tetrahydro-1,5-benzodiazepine-2-thione;74389-71-2;1H-1,5-BENZODIAZEPINE-2-THIONE, 2,3,4,5-TETRAHYDRO-4-METHYL-;5-24-02-00518 (Beilstein Handbook Reference);Oprea1_576924;SCHEMBL13729295;DTXSID00995902;IZJYTDCZXXJUGJ-UHFFFAOYSA-N;LS-34128;2-Methyl-2,3-dihydro-1H-1,5-benzodiazepine-4-thiol;2,3,4,5-Tetrahydro-4-methyl-1H-1,5-benzodiazepine-2-thione;4-methyl-4,5-dihydro-1H-benzo[b][1,4]diazepine-2(3H)-thione

Suppliers and Price of 1H-1,5-Benzodiazepine-2-thione, 2,3,4,5-tetrahydro-4-methyl-

Supply Marketing:

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

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Chemical Property of 1H-1,5-Benzodiazepine-2-thione, 2,3,4,5-tetrahydro-4-methyl-

Chemical Property:

Vapor Pressure:0.000434mmHg at 25°C
Boiling Point:315.6°Cat760mmHg
Flash Point:144.6°C
Density:1.21g/cm³
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:192.07211956
Heavy Atom Count:13
Complexity:205

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CC(=S)NC2=CC=CC=C2N1

Technology Process of 1H-1,5-Benzodiazepine-2-thione, 2,3,4,5-tetrahydro-4-methyl-

There total 5 articles about 1H-1,5-Benzodiazepine-2-thione, 2,3,4,5-tetrahydro-4-methyl- 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: 83.0%

: 3967-01-9
4-methyl-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-one

: 74389-71-2
4-methyl-4,5-dihydro-1H-benzo[b][1,4]diazepine-2(3H)-thione

Guidance literature:: With tetraphosphorus decasulfide; In pyridine; at 120 ℃; for 0.5h; Product distribution / selectivity;

Reference yield:

: 1493-27-2,127723-77-7
ortho-nitrofluorobenzene

: 74389-71-2
4-methyl-4,5-dihydro-1H-benzo[b][1,4]diazepine-2(3H)-thione

Guidance literature:: Multi-step reaction with 4 steps

1: potassium carbonate / tetrahydrofuran / 36 h / 100 °C

2: hydrogen / palladium on activated charcoal / ethyl acetate; ethanol / 3 h / 20 °C

3: sodium methylate / methanol / 48 h / Reflux

4: tetraphosphorus decasulfide / pyridine / 0.5 h / 120 °C

With tetraphosphorus decasulfide; hydrogen; sodium methylate; potassium carbonate; palladium on activated charcoal; In tetrahydrofuran; pyridine; methanol; ethanol; ethyl acetate;

Reference yield:

: 1407835-16-8
ethyl 3-(2-nitrophenylamino)butanoate

: 74389-71-2
4-methyl-4,5-dihydro-1H-benzo[b][1,4]diazepine-2(3H)-thione

Guidance literature:: Multi-step reaction with 3 steps

1: hydrogen / palladium on activated charcoal / ethyl acetate; ethanol / 3 h / 20 °C

2: sodium methylate / methanol / 48 h / Reflux

3: tetraphosphorus decasulfide / pyridine / 0.5 h / 120 °C

With tetraphosphorus decasulfide; hydrogen; sodium methylate; palladium on activated charcoal; In pyridine; methanol; ethanol; ethyl acetate;