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Ethyl 4-bromomethylcinnamate is an organic compound with the molecular formula C12H11BrO2. It is characterized by the presence of a bromomethyl group and a cinnamate moiety, which contribute to its chemical properties and potential applications.

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  • 60682-98-6 Structure
  • Basic information

    1. Product Name: Ethyl 4-bromomethylcinnamate
    2. Synonyms: 3-(4-Brommethyl)-phenylpropenoic acid ethyl ester;ethyl 3-(4-bromomethyl)cinnamate;Ethyl 4-bromomethylcinnamate;3-(4-Brommethyl)-Phenyl-PropenoicAcid(C12H13BrO2);2-PropenoicAcid,3-[4-(Bromomethyl)-Phenyl]-Ethyl;ETHYL-3-(PARA-(BROMOMETHYL)PHENYL)ACRYLATE;ETHYL(E)-3-(P-(BROMOMETHYL)PHENYL)ACRYLATE;Ethyl 4-bromomethylc
    3. CAS NO:60682-98-6
    4. Molecular Formula: C12H13BrO2
    5. Molecular Weight: 269.13
    6. EINECS: 200-528-9
    7. Product Categories: Cinnamic acid;Aromatics;Inhibitors;Intermediates & Fine Chemicals;Pharmaceuticals
    8. Mol File: 60682-98-6.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 348°C
    3. Flash Point: 164°C
    4. Appearance: /
    5. Density: 1.370
    6. Vapor Pressure: 5.27E-05mmHg at 25°C
    7. Refractive Index: 1.585
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: Ethyl 4-bromomethylcinnamate(CAS DataBase Reference)
    11. NIST Chemistry Reference: Ethyl 4-bromomethylcinnamate(60682-98-6)
    12. EPA Substance Registry System: Ethyl 4-bromomethylcinnamate(60682-98-6)
  • 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: 60682-98-6(Hazardous Substances Data)

60682-98-6 Usage

Uses

Used in Pharmaceutical Industry:
Ethyl 4-bromomethylcinnamate is used as a key intermediate in the synthesis of cinnamamide derivatives, which are known to act as 5α-reductase inhibitors. These inhibitors play a crucial role in the treatment of various androgenetic disorders, such as benign prostatic hyperplasia (BPH) and androgenetic alopecia (male pattern baldness). By inhibiting the enzyme 5α-reductase, these cinnamamide derivatives help regulate the conversion of testosterone to dihydrotestosterone (DHT), thereby mitigating the symptoms associated with these conditions.

Check Digit Verification of cas no

The CAS Registry Mumber 60682-98-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 6,0,6,8 and 2 respectively; the second part has 2 digits, 9 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 60682-98:
(7*6)+(6*0)+(5*6)+(4*8)+(3*2)+(2*9)+(1*8)=136
136 % 10 = 6
So 60682-98-6 is a valid CAS Registry Number.
InChI:InChI=1/C12H13BrO2/c1-2-15-12(14)8-7-10-3-5-11(9-13)6-4-10/h3-8H,2,9H2,1H3/b8-7+

60682-98-6SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name Ethyl 4-Bromomethylcinnamate

1.2 Other means of identification

Product number -
Other names Ethyl 4-bromomethylcinnamate

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:60682-98-6 SDS

60682-98-6Upstream product

60682-98-6Relevant articles and documents

Synthesis method of ozagrel intermediate phenol bromomethyl cinnamate

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Paragraph 0033; 0034; 0035; 0036; 0037; 0038, (2019/06/27)

The invention discloses a synthesis method of bromomethyl cinnamate by uisng an ozagrel intermediate, which is characterized in that the p-bromomethyl cinnamate is brominated to obtain phenol bromomethyl cinnamate, and the reaction process comprises the following steps of: 1) under the condition of protective gas, uniformly mixing the p-bromomethyl cinnamate, an auxiliary substance and a solvent A, controlling the reaction temperature to be 110-130 DEG C and the pressure to be 4-6 atmospheric pressures, stirring for 1-2h, maintaining the reaction conditions, starting to drop a mixed aqueous solution C of brominated salt and glacial acetic acid, controlling the dropping time to be 1-3 hours, controlling the temperature to be 140-160 DEG C after dropping, controlling the pressure to be 7-10-10 atmospheric pressures, and finishing the reaction after 4-6 hours; 2) cooling the system, pouring the reaction product into 2-4 times of volume of water, adding a solvent B for extraction, layering, washing an organic layer by water, drying by a drying agent, and concentrating and evaporating to remove the solvent to obtain the product. The synthesis method has the advantages of good selectivity, low cost and high yield.

6-Membered heterocyclic compound and use thereof

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Page/Page column 219, (2008/06/13)

A compound represented by the general formula (I) or a salt thereof: [T represents oxygen atom and the like; V represents CH2 and the like; RO1 to RO4 represent hydrogen atom and the like; A represents a linear alkylene group or linear alkenylene group having 2 to 8 carbon atoms and the like; D represents carboxyl group and the like; X represents ethylene group, trimethylene group and the like; E represents —CH(OH)— group and the like; and W represent —U1—(RW1)(RW2)—U2—U3 group (U1 represents a single bond, an alkylene group having 1 to 4 carbon atoms and the like; RW1 and RW2 represent hydrogen atom and the like; U2 represents a single bond, an alkylene group having 1 to 4 carbon atoms and the like; and U3 represent an alkyl group having 1 to 8 carbon atoms and the like), or a residue of a carbon ring or heterocyclic compound], which can be utilized as an active ingredient of medicaments effective for prophylactic and/or therapeutic treatment of skeletal diseases such as osteoporosis and fracture, glaucoma, ulcerative colitis and the like.

The Application of the Hammett Equation to 13C N.M.R. Spectrometry. V. The Transmission of Electronic Effects Through Azophenylene and Ethenylphenylene Groups

Christoforou, Demetrius,Happer, Duncan A. R.

, p. 729 - 738 (2007/10/02)

The 13C n.m.r. spectra of a number of ethyl (3-aryl)azo-, (4-aryl)azo-, 2-(4-arylethenyl)-cinnamates have been measured in CDCl3.Comparision of the data with those for the corresponding ethyl 3-arylpropenoates has been used to investigate the attenuation of electronic effects by the 3- and 4-azophenylene and the 4-ethenylphenylene linkages.

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