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TERT-BUTYL N-(3-AMINO-3-THIOXOPROPYL)CARBAMATE is a carbamate derivative with the molecular formula C9H18N2O2S, derived from tert-butyl isocyanate and 3-amino-3-thioxopropanol. It is a chemical compound that belongs to a class of organic compounds containing the functional group -NHCOO-. TERT-BUTYL N-(3-AMINO-3-THIOXOPROPYL)CARBAMATE is commonly used in organic synthesis and pharmaceutical research due to its potential therapeutic properties and ability to interact with biological targets. However, it requires careful handling and storage to avoid potential health hazards.

77152-97-7

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77152-97-7 Usage

Uses

Used in Organic Synthesis:
TERT-BUTYL N-(3-AMINO-3-THIOXOPROPYL)CARBAMATE is used as a reagent in organic synthesis for its ability to form various chemical compounds and contribute to the development of new molecules with potential applications.
Used in Pharmaceutical Research:
In the pharmaceutical industry, TERT-BUTYL N-(3-AMINO-3-THIOXOPROPYL)CARBAMATE is utilized as a research compound to explore its potential therapeutic properties. Its interaction with biological targets makes it a promising candidate for the development of new drugs and treatments.
Used in Drug Development:
TERT-BUTYL N-(3-AMINO-3-THIOXOPROPYL)CARBAMATE is employed in drug development as a starting material or intermediate in the synthesis of pharmaceutical compounds. Its unique structure and functional group provide opportunities for the creation of novel therapeutic agents.

Check Digit Verification of cas no

The CAS Registry Mumber 77152-97-7 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,7,1,5 and 2 respectively; the second part has 2 digits, 9 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 77152-97:
(7*7)+(6*7)+(5*1)+(4*5)+(3*2)+(2*9)+(1*7)=147
147 % 10 = 7
So 77152-97-7 is a valid CAS Registry Number.
InChI:InChI=1/C8H16N2O2S/c1-8(2,3)12-7(11)10-5-4-6(9)13/h4-5H2,1-3H3,(H2,9,13)(H,10,11)

77152-97-7SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name tert-butyl N-(3-amino-3-sulfanylidenepropyl)carbamate

1.2 Other means of identification

Product number -
Other names N-Boc-3-aminopropanethioamide

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:77152-97-7 SDS

77152-97-7Relevant academic research and scientific papers

Synthesis of novel amide and urea derivatives of thiazol-2-ethylamines and their activity against Trypanosoma brucei rhodesiense

Patrick, Donald A.,Wenzler, Tanja,Yang, Sihyung,Weiser, Patrick T.,Wang, Michael Zhuo,Brun, Reto,Tidwell, Richard R.

, p. 2451 - 2465 (2016/05/19)

2-(2-Benzamido)ethyl-4-phenylthiazole (1) was one of 1035 molecules (grouped into 115 distinct scaffolds) found to be inhibitory to Trypanosoma brucei, the pathogen causing human African trypanosomiasis, at concentrations below 3.6 μM and non-toxic to mammalian (Huh7) cells in a phenotypic high-throughput screen of a 700,000 compound library performed by the Genomics Institute of the Novartis Research Foundation (GNF). Compound 1 and 72 analogues were synthesized in this lab by one of two general pathways. These plus 10 commercially available analogues were tested against T. brucei rhodesiense STIB900 and L6 rat myoblast cells (for cytotoxicity) in vitro. Forty-four derivatives were more potent than 1, including eight with IC50 values below 100 nM. The most potent and most selective for the parasite was the urea analogue 2-(2-piperidin-1-ylamido)ethyl-4-(3-fluorophenyl)thiazole (70, IC50 = 9 nM, SI > 18,000). None of 33 compounds tested were able to cure mice infected with the parasite; however, seven compounds caused temporary reductions of parasitemia (≥97%) but with subsequent relapses. The lack of in vivo efficacy was at least partially due to their poor metabolic stability, as demonstrated by the short half-lives of 15 analogues against mouse and human liver microsomes.

A convenient synthesis of ethyl 3-aminopropanedithioate (β-alanine ethyl dithioester)

Josse, Olivier,Labar, Daniel,Marchand-Brynaert, Jacqueline

, p. 404 - 406 (2007/10/03)

A five-step sequence allowing the preparation of ethyl 3- aminopropanedithioate from N-(Boc)-β-alanine via the key intermediate N- (Boc)-β-alaninethioacyl-N-phthalimide is described.

Dithio and thiono esters, LVII: Synthesis of dithio and thiono esters of N-protected β- and γ-amino acids

Brutsche,Hartke

, p. 271 - 276 (2007/10/02)

The N-protected β-aminonitriles 1 were transformed into the imidoester or thiolimidoester hydrochlorides 2 or 3 according to Pinner and sulfhydrolyzed with H2S to give the N-protected β-amino thiono esters 4 or dithio esters 5. Alkylation of th

Acylation of Dibasic Compounds Containing Amino Amidine and Aminoguanidine Functions

Barker, Peter L.,Gendler, Paul L.,Rapoport, Henry

, p. 2455 - 2465 (2007/10/02)

The site of acylation in difunctional compounds containing an amine and either an amidine or guanidine can be determined from the ultraviolet absorption spectrum of the acylated product.If the amidine or guanidine has been acylated, the product possesses a chromophore that is pH dependent, whereas if an amide was formed, the chromophore is independent of pH.

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