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Ethanone, 2-phenyl-1-(1H-pyrrol-2-yl)-, also known as 2-phenyl-1-(1H-pyrrol-2-yl)ethanone, is a chemical compound characterized by the molecular formula C13H11NO. It is a ketone derivative featuring a phenyl and a pyrrole group attached to the carbonyl carbon. Ethanone, 2-phenyl-1-(1H-pyrrol-2-yl)is recognized for its aromatic and colorless properties, and it is valued in the fields of organic synthesis and pharmaceutical research due to its potential pharmacological properties. It serves as a versatile building block in the creation of various bioactive molecules and pharmaceutical drugs. Its reactivity and selectivity in chemical reactions make it a common choice in laboratory settings. However, due to its potentially hazardous nature and potential health risks, it is crucial to handle this compound with care and adhere to proper safety protocols.

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  • 13169-74-9 Structure
  • Basic information

    1. Product Name: Ethanone, 2-phenyl-1-(1H-pyrrol-2-yl)-
    2. Synonyms:
    3. CAS NO:13169-74-9
    4. Molecular Formula: C12H11NO
    5. Molecular Weight: 185.225
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 13169-74-9.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: N/A
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: Ethanone, 2-phenyl-1-(1H-pyrrol-2-yl)-(CAS DataBase Reference)
    10. NIST Chemistry Reference: Ethanone, 2-phenyl-1-(1H-pyrrol-2-yl)-(13169-74-9)
    11. EPA Substance Registry System: Ethanone, 2-phenyl-1-(1H-pyrrol-2-yl)-(13169-74-9)
  • 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: 13169-74-9(Hazardous Substances Data)

13169-74-9 Usage

Uses

Used in Organic Synthesis:
Ethanone, 2-phenyl-1-(1H-pyrrol-2-yl)is utilized as a key intermediate in organic synthesis for the preparation of complex organic molecules. Its unique structure allows for various chemical reactions, making it a valuable component in the synthesis of a wide range of compounds.
Used in Pharmaceutical Research:
In pharmaceutical research, this compound is employed as a precursor in the development of new drugs. Its potential pharmacological properties make it a promising candidate for the creation of bioactive molecules with therapeutic applications.
Used in Drug Development:
Ethanone, 2-phenyl-1-(1H-pyrrol-2-yl)is used as a building block in drug development for the production of pharmaceutical drugs. Its structural features contribute to the design and synthesis of novel therapeutic agents with potential applications in treating various diseases and conditions.
Used in Laboratory Research:
Ethanone, 2-phenyl-1-(1H-pyrrol-2-yl)is also used in laboratory research settings for its reactivity and selectivity in chemical reactions. It serves as a model compound for studying reaction mechanisms and developing new synthetic methodologies.
Used in Chemical Education:
Ethanone, 2-phenyl-1-(1H-pyrrol-2-yl)is utilized in chemical education to demonstrate the principles of organic chemistry, including the properties of ketones, the reactivity of functional groups, and the synthesis of complex organic molecules.

Check Digit Verification of cas no

The CAS Registry Mumber 13169-74-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,3,1,6 and 9 respectively; the second part has 2 digits, 7 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 13169-74:
(7*1)+(6*3)+(5*1)+(4*6)+(3*9)+(2*7)+(1*4)=99
99 % 10 = 9
So 13169-74-9 is a valid CAS Registry Number.

13169-74-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-phenyl-1-(1H-pyrrol-2-yl)ethanone

1.2 Other means of identification

Product number -
Other names 2-phenyl-1-pyrrol-2-yl-ethanone

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:13169-74-9 SDS

13169-74-9Relevant articles and documents

Practical Cu(OAc)2/TEMPO-catalyzed selective aerobic alcohol oxidation under ambient conditions in aqueous acetonitrile

Jiang, Jian-An,Du, Jia-Lei,Wang, Zhan-Guo,Zhang, Zhong-Nan,Xu, Xi,Zheng, Gan-Lin,Ji, Ya-Fei

supporting information, p. 1677 - 1681 (2014/03/21)

We reported a ligand-and additive-free Cu(OAc)2/TEMPO catalyst system that enables efficient and selective aerobic oxidation of a broad range of primary and secondary benzylic alcohols, primary and secondary 1-heteroaryl alcohols, cinnamyl alcohols, and aliphatic alcohols to the corresponding aldehydes and ketones. This ambient temperature oxidation protocol is of practical features like aqueous acetonitrile as solvent, ambient air as the terminal oxidant, and low catalyst loading, presenting a potential value in terms of both economical and environmental considerations. Based on the experimental observations, a plausible reaction mechanism was proposed.

Solvent free synthesis of 2-acylpyrroles and its derivatives catalysed by reuseable zinc oxide

Zhang, Shuguang,Feng, Chengliang,Cai, Jin,Chen, Junqing,Hu, Huayou,Ji, Min

, p. 480 - 482 (2013/09/12)

A highly efficient procedure for preparing 2-acylpyrroles and its derivatives is described. The products were obtained through regioselective Friedel-Crafts reactions of pyrroles and its derivatives with alkyl or aryl acid chlorides catalysed by zinc oxide under solvent-free conditions. This method has the advantages of green chemistry, operational simplicity, solvent-free conditions, and recoverable catalyst.

Friedel-Crafts acylation of arenes with carboxylic acids using silica gel supported AlCl3

Parvanak Boroujeni, Kaveh

experimental part, p. 621 - 630 (2010/11/04)

Aromatic compounds react smoothly with carboxylic acids in the presence of silica gel supported aluminium trichloride to afford the corresponding ketones with high regioselectivity in high to excellent yields. The catalyst is stable (as a bench top catalyst) and can be easily recovered and reused without appreciable change in its efficiency. tuebitak.

±2-[Phenethyl]-5-[(3,4-methylenedioxy)-α-hydroxybenzyl]pyrrolidine antihypertensives and use thereas

-

, (2008/06/13)

A compound of the formula STR1 and the pharmaceutically acceptable acid addition salts thereof are potent antihypertensive agents and are therefore useful as cardiovascular system regulators.

FRIEDEL-CRAFTS ACYLATION OF 1-TERT-BUTYLDIMETHYLSILYLPYRROLE, A VERY SHORT AND SIMPLE ROUTE TO 3-SUBSTITUTED PYRROLES.

Simchen, Gerhard,Majchrzak, Michal W.

, p. 5035 - 5036 (2007/10/02)

1-tert-Butyldimethylsilylpyrrole undergoes Friedel-Crafts acylation almost exclusively at β-position giving after sodium fluoride supported hydrolysis the 3-pyrroloketones.

Synthesis of Alkylpyrroles by the Sodium Borohydride Reduction of Acylpyrroles

Greenhouse, Robert,Ramirez, Coral,Muchowski, Joseph M.

, p. 2961 - 2965 (2007/10/02)

N-Unsubstituted alkylpyrroles are obtained by the reduction of the corresponding acylpyrroles with sodium borohydride in boiling 2-propanol.This reaction was demonstrated to proceed via the pyrrolylalkylcarbinol and was extended to the synthesis of a branched chain alkylpyrrole 25 from the tertiary alcohol 24.

Zur Reaktion von Cyclopropenonen mit Azomethinen; VII. Diphenylcyclopropenon und cyclische Amidine: Synthese von bi- und tricyclischen Pyrrolinon-Derivaten

Eicher, Theophil,Rohde, Ralph

, p. 619 - 625 (2007/10/02)

Reaction of diphenylcyclopropenone (1) with cyclic amidines 2 or 10-13 gives rise to bi- and tricyclic pyrrolinone derivatives of different structural types (3 or 14-17), which can be transformed in simple sequences to pyrrolinone-annellated heterobi- and -tricyclic compounds (7, 18-21).

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