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ETHYL 2-(1-BENZHYDRYLAZETIDIN-3-YLIDENE) ACETATE is a chemical compound characterized by its unique structure, derived from azetidine—a four-membered ring with nitrogen as the heteroatom—and ethyl acetate. It is a yellow liquid with a molecular formula of C16H19NO2 and a molecular weight of 257.33 g/mol. ETHYL 2-(1-BENZHYDRYLAZETIDIN-3-YLIDENE) ACETATE holds potential in the realms of organic synthesis and pharmaceuticals due to its distinctive structural properties, and it may also be utilized in the development of new drugs and as a building block for synthesizing other complex organic molecules. Ongoing research is exploring its properties and potential applications further.

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  • 158602-32-5 Structure
  • Basic information

    1. Product Name: ETHYL 2-(1-BENZHYDRYLAZETIDIN-3-YLIDENE) ACETATE
    2. Synonyms: ETHYL 2-(1-BENZHYDRYLAZETIDIN-3-YLIDENE) ACETATE;Acetic acid, 2-[1-(diphenylMethyl)-3-azetidinylidene]-, ethyl ester
    3. CAS NO:158602-32-5
    4. Molecular Formula: C20H21NO2
    5. Molecular Weight: 307.4
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 158602-32-5.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 415.6±35.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.191±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. PKA: 5.60±0.20(Predicted)
    10. CAS DataBase Reference: ETHYL 2-(1-BENZHYDRYLAZETIDIN-3-YLIDENE) ACETATE(CAS DataBase Reference)
    11. NIST Chemistry Reference: ETHYL 2-(1-BENZHYDRYLAZETIDIN-3-YLIDENE) ACETATE(158602-32-5)
    12. EPA Substance Registry System: ETHYL 2-(1-BENZHYDRYLAZETIDIN-3-YLIDENE) ACETATE(158602-32-5)
  • Safety Data

    1. Hazard Codes: Xn
    2. Statements: 22
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 158602-32-5(Hazardous Substances Data)

158602-32-5 Usage

Uses

Used in Organic Synthesis:
ETHYL 2-(1-BENZHYDRYLAZETIDIN-3-YLIDENE) ACETATE is used as a reagent in organic synthesis for its unique structural properties that facilitate the creation of complex organic molecules.
Used in Pharmaceutical Industry:
In the pharmaceutical industry, ETHYL 2-(1-BENZHYDRYLAZETIDIN-3-YLIDENE) ACETATE is used as a precursor in the development of new drugs, leveraging its distinctive chemical structure to contribute to the synthesis of novel medicinal compounds.
Used in Research and Development:
ETHYL 2-(1-BENZHYDRYLAZETIDIN-3-YLIDENE) ACETATE is utilized in research and development settings to explore its properties and potential applications, with ongoing studies aiming to uncover its full potential in various chemical and pharmaceutical processes.

Check Digit Verification of cas no

The CAS Registry Mumber 158602-32-5 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,5,8,6,0 and 2 respectively; the second part has 2 digits, 3 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 158602-32:
(8*1)+(7*5)+(6*8)+(5*6)+(4*0)+(3*2)+(2*3)+(1*2)=135
135 % 10 = 5
So 158602-32-5 is a valid CAS Registry Number.

158602-32-5SDS

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 ethyl 2-(1-benzhydrylazetidin-3-ylidene)acetate

1.2 Other means of identification

Product number -
Other names 2-[1-(Diphenylmethyl)-3-Azetidinylidene]-Acetic Acid Ethyl Ester

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:158602-32-5 SDS

158602-32-5Relevant articles and documents

Design, Synthesis, and Biological Evaluation of Novel Pyrimido[4,5-b]indole Derivatives against Gram-Negative Multidrug-Resistant Pathogens

Kong, Qidi,Pan, Wei,Xu, Heng,Xue, Yaru,Guo, Bin,Meng, Xin,Luo, Cheng,Wang, Ting,Zhang, Shuhua,Yang, Yushe

supporting information, p. 8644 - 8665 (2021/06/28)

Due to the poor permeability across Gram-negative bacterial membranes and the troublesome bacterial efflux mechanism, only a few GyrB/ParE inhibitors with potent activity against Gram-negative pathogens have been reported. Among them, pyrimido[4,5-b]indol

NOVEL PYRIDONE CARBOXYLIC ACID DERIVATIVE OR SALT THEREOF

-

Paragraph 0890-0892, (2020/03/09)

It is intended to provide a novel compound having high antitumor activity and low toxicity to normal cells. The present invention provides a pyridone carboxylic acid derivative represented by the following formula (1) or a salt thereof wherein R1 represents a hydrogen atom, a halogen atom or the like; R2 represents a hydrogen atom, a halogen atom or the like; R3 to R6 each represent a hydrogen atom or the like; R7 represents a hydrogen atom or the like; R8 represents a hydrogen atom, a halogen atom, the following formula (a) (wherein Ra1 and Ra2 each represent a hydrogen atom, a hydroxy group, an optionally substituted lower alkyl group or the like) or the like, or R7 and R8 together represent —N—OR10 (wherein R10 represents a hydrogen atom, an optionally substituted lower alkyl group, or an aralkyl group), or R7 and R8 form an optionally substituted 4- to 6-membered saturated hetero ring together with the adjacent carbon atom, or the like; R9 represents a hydrogen atom or the like; X represents a nitrogen atom or the like; and Y represents a nitrogen atom or the like.

Preparation method of tert-butyl-5-(hydroxymethyl)-7-oxa-2-azaspiro[3.5]nonane-2-formate

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Paragraph 0006; 0007; 0013; 0014, (2019/12/25)

The invention relates to a preparation method of tert-butyl-5-(hydroxymethyl)-7-oxa-2-azaspiro[3.5]nonane-2-formate, and mainly solves the technical problem that no proper industrial synthesis methodexists at present. The product is synthesized by six steps, and the preparation method comprises the steps: a first step, a compound 1 is subjected to Swern oxidation reaction to generate a compound 2; a second step, a compound 3 is obtained through a Horner-Wadsworth-Emmons reaction; a third step, a compound 4 is obtained through Michael addition; a fourth step, a compound 5 is obtained through reduction of the compound 4 with lithium tetrahydroaluminum; a fifth step, the compound 5 is dehydrated and retained with a ring to obtain a compound 6 under the action of sodium hydrogen; and a sixthstep, hydrogenation is preformed to remove a protective group, and then a protective group is added to obtain the target compound 7. The obtained compound is a useful intermediate or product for synthesis of many drugs.

Rhodium catalyzed C-C bond cleavage/coupling of 2-(azetidin-3-ylidene)acetates and analogs

Yang, Xuan,Kong, Wei-Yu,Gao, Jia-Ni,Cheng, Li,Li, Nan-Nan,Li, Meng,Li, Hui-Ting,Fan, Jun,Gao, Jin-Ming,Ouyang, Qin,Xie, Jian-Bo

supporting information, p. 12707 - 12710 (2019/10/28)

The C-C bond cleavage/coupling of 2-(azetidin-3-ylidene)acetates with aryl boronic acids catalyzed by a rhodium complex was studied with a "conjugate addition/β-C cleavage/protonation" strategy.

AZETIDINYL QUINOLONES AS ANTIBACTERIAL AGENTS

-

Page 46-47, (2008/06/13)

Compounds of formula (I) and methods for their preparation are disclosed. Further disclosed are methods of making biologically active compounds of formula (I) as well as pharmaceutically acceptable compositions comprising compounds of formula (I). Compoun

QUINAZOLINE-2, 4-DIONES AS ANTIBACTERIAL AGENTS

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Page 44, (2008/06/13)

Compounds of formula I and methods for their preparation are disclosed. Further disclosed are methods of making biologically active compounds of formula I as well as pharmaceutically acceptable compositions comprising compounds of formula I. Compounds of

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