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(2-ACETYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER is a chemical compound with the molecular formula C13H15NO3. It is a derivative of carbamic acid, and its structure consists of a tert-butyl ester group and an acetylphenyl group. (2-ACETYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER is known for its potential applications in various fields, particularly in the synthesis of pharmaceuticals and agrochemicals.

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  • 314773-77-8 Structure
  • Basic information

    1. Product Name: (2-ACETYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER
    2. Synonyms: (2-ACETYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER;tert-Butyl (2-acetylphenyl)carbamate
    3. CAS NO:314773-77-8
    4. Molecular Formula: C13H17NO3
    5. Molecular Weight: 235.28
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 314773-77-8.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: (2-ACETYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER(CAS DataBase Reference)
    10. NIST Chemistry Reference: (2-ACETYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER(314773-77-8)
    11. EPA Substance Registry System: (2-ACETYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER(314773-77-8)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 314773-77-8(Hazardous Substances Data)

314773-77-8 Usage

Uses

Used in Pharmaceutical Industry:
(2-ACETYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER is used as an intermediate in the synthesis of pharmaceuticals for its ability to contribute to the development of new drugs and medications. Its unique structure allows it to be a valuable building block in creating a wide range of therapeutic agents.
Used in Agrochemical Industry:
In the agrochemical industry, (2-ACETYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER is utilized as an intermediate in the synthesis of agrochemicals, such as pesticides and herbicides. Its role in these applications is crucial for enhancing crop protection and improving agricultural productivity.
Used in Organic Compound Production:
(2-ACETYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER is used as a building block in the production of various organic compounds. Its versatile structure makes it suitable for creating a broad spectrum of organic molecules for different applications.
Used in Synthetic Materials Preparation:
(2-ACETYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER is also used in the preparation of synthetic materials, where its unique properties can be leveraged to develop new materials with specific characteristics for various industries.
Used in Pharmacological and Medicinal Research:
Due to its biological activity, (2-ACETYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER is a potential candidate for research in pharmacological and medicinal applications. Its exploration in these fields can lead to the discovery of new therapeutic agents and treatments.

Check Digit Verification of cas no

The CAS Registry Mumber 314773-77-8 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 3,1,4,7,7 and 3 respectively; the second part has 2 digits, 7 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 314773-77:
(8*3)+(7*1)+(6*4)+(5*7)+(4*7)+(3*3)+(2*7)+(1*7)=148
148 % 10 = 8
So 314773-77-8 is a valid CAS Registry Number.

314773-77-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name (2-acetyl-phenyl)-carbamic acid tert-butyl ester

1.2 Other means of identification

Product number -
Other names tert-Butyl (2-acetylphenyl)carbamate

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:314773-77-8 SDS

314773-77-8Relevant articles and documents

An efficient synthesis of ortho-N-Boc-arylmethyl ketone derivatives

Broutin, Pierre-Emmanuel,Hilty, Peter,Thomas, Andrew W.

, p. 6429 - 6432 (2003)

A new and efficient method for the preparation of ortho-N-Boc-arylmethyl ketone derivatives is reported. The reaction involves the intermediacy of a 4-methylene-3,1-benzoaxin-2-one moiety which smoothly converts to the target compounds under acidic conditions. The ortho-N-Boc-arylmethyl ketone derivatives can be formed in a one-pot reaction or alternatively the 4-methylene-3,1-benzoaxin-2-ones can be isolated and subsequently transformed into the desired products.

A Convenient Formal [4+2] Heterocylization Route to Bis(triflyl)tetrahydroquinolines

Lázaro-Milla, Carlos,Almendros, Pedro

supporting information, p. 13534 - 13538 (2021/08/13)

We report the sustainable and efficient synthesis of a new type of quinoline derivatives bearing one or two SO2CF3 groups. The protocol is metal-, catalyst- and irradiation-free, involves the use of readily available and stable precursors, and avoids the formation of side products. Also, the mild conditions of the process allow the tolerance of a wide range of functional groups.

Rational modification, synthesis and biological evaluation of 3,4-dihydroquinoxalin-2(1H)-one derivatives as potent and selective c-Jun N-terminal kinase 3 (JNK3) inhibitors

Dou, Xiaodong,Huang, Huixia,Jiang, Lan,Jiao, Ning,Jin, Hongwei,Liu, Zhenming,Zhang, Liangren,Zhang, Lihe,Zhu, Guiwang

, (2020/07/03)

The c-Jun N-terminal kinase 3 (JNK3) plays key roles in a wide range of diseases, including neurodegeneration diseases, inflammation diseases, cancers, cardiovascular diseases, and metabolic disorders. Previously, we have identified a lead compound, (Z)-3

Construction of 1H-indazoles from ortho-aminobenzoximes by the Mitsunobu reaction

Conlon, Ivie L.,Konsein, Katie,Morel, Yulemni,Chan, Alexandria,Fletcher, Steven

, (2019/08/22)

Recently, there has been an upsurge in the occurrence of the indazole motif in drug discovery. Accordingly, newer, milder and more efficient routes towards their synthesis have emerged in the literature. We recently reported the Mitsunobu-triggered cyclod

One pot synthesis of α-ketoamides from ethylarenes and amines: a metal free difunctionalization strategy

Ramanathan, Mani,Kuo, Chun-Kai,Liu, Shiuh-Tzung

, p. 11446 - 11453 (2016/12/16)

One-pot and metal free synthesis of α-ketoamides has been described through in situ generation of aryl ketones from easily available ethylarenes followed by amidation with various amines. This multiple oxidation protocol involves catalytic I2-pyridine-TBHP (t-butyl hydroperoxide) mediated oxidative benzylic carbonylation and sequential NaI-TBHP mediated oxidative amidation without using any solvent.

N-Heterocyclic Carbene-Catalyzed Synthesis of 2-Aryl Indoles

-

Paragraph 0064-0065, (2015/11/27)

Transition metal-free catalytic methods for access to 2-arylindole compounds.

N-heterocyclic-carbene-catalyzed synthesis of 2-aryl indoles

Hovey, M. Todd,Check, Christopher T.,Sipher, Alexandra F.,Scheidt, Karl A.

supporting information, p. 9603 - 9607 (2014/10/15)

A convergent and efficient transition-metal-free catalytic synthesis of 2-aryl-indoles has been developed. The interception of a highly reactive and transient aza-ortho-quinone methide by an acyl anion equivalent generated through N-hetereocyclic carbene catalysis is central to this successful strategy. High yields and a wide scope as well as the streamlined synthesis of a kinase inhibitor are reported. Umpolung: N-heterocyclic carbene catalysis is used for the convergent and efficient transition-metal-free synthesis of 2-aryl-indoles. The interception of a highly reactive and transient aza-ortho-quinone methide by an acyl anion equivalent is central to this successful strategy. The reaction exhibits high yields and a wide scope, and it has been applied to a streamlined synthesis of a kinase inhibitor.

Enzymatic kinetic resolution of tert-butyl 2-(1-Hydroxyethyl) phenylcarbamate, a key intermediate to chiral organoselenanes and organotelluranes

Piovan, Leandro,Pasquini, Monica D.,Andrade, Leandro H.

experimental part, p. 8098 - 8109 (2011/11/06)

The enzymatic kinetic resolution of tert-butyl 2-(1-hydroxyethyl) phenylcarbamate via lipase-catalyzed transesterification reaction was studied. We investigated several reaction conditions and the carbamate was resolved by Candida antarctica lipase B (CAL

THIADIAZOLINE DERIVATIVES

-

Page/Page column 40; 43, (2010/11/08)

An antitumor agent comprising a thiadiazoline derivative represented by the general formula (I), or a pharmacologically acceptable salt thereof as an active ingredient: (wherein Z represents a sulfur atom and the like, R1 represents substituted or unsubstituted lower alkynyl and the like, R2 represents a hydrogen atom and the like, R3 represents substituted or unsubstituted lower alkyl and the like, and R4 represents substituted or unsubstituted aryl and the like), and the like are provided.

THERAPEUTIC AGENT FOR RESTENOSIS

-

Page/Page column 81-82, (2010/11/25)

A therapeutic and/or prophylactic agent for restenosis comprising a thiadiazoline derivative represented by the general formula (O) or a pharmaceutically acceptable salt thereof: wherein n represents an integer of 1 to 3; R0 represents an aryl,

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