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139284-99-4

The chemical "2-Propenoic acid, 3-[1-[(4-methylphenyl)sulfonyl]-1H-imidazol-4-yl]-, methyl ester, (E)-" is a complex organic compound with the molecular formula C13H14N2O4S. It is a derivative of 2-propenoic acid, featuring a methyl ester group and an imidazole ring. The imidazole ring is substituted with a sulfonyl group attached to a 4-methylphenyl group, indicating a potential for strong electrophilic properties. 2-Propenoic acid, 3-[1-[(4-methylphenyl)sulfonyl]-1H-imidazol-4-yl]-, methyl ester, (E)- is characterized by its (E)-configuration, which refers to the geometric isomerism around the double bond, suggesting a specific arrangement of the substituents. It is likely to be used in pharmaceutical or chemical research due to its unique structure and potential reactivity.

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  • 139284-99-4 Structure

  • Basic information

    1. Product Name: 2-Propenoic acid, 3-[1-[(4-methylphenyl)sulfonyl]-1H-imidazol-4-yl]-, methyl ester, (E)-
    2. Synonyms:
    3. CAS NO:139284-99-4
    4. Molecular Formula: C14H14N2O4S
    5. Molecular Weight: 306.342
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 139284-99-4.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: 2-Propenoic acid, 3-[1-[(4-methylphenyl)sulfonyl]-1H-imidazol-4-yl]-, methyl ester, (E)-(CAS DataBase Reference)
    10. NIST Chemistry Reference: 2-Propenoic acid, 3-[1-[(4-methylphenyl)sulfonyl]-1H-imidazol-4-yl]-, methyl ester, (E)-(139284-99-4)
    11. EPA Substance Registry System: 2-Propenoic acid, 3-[1-[(4-methylphenyl)sulfonyl]-1H-imidazol-4-yl]-, methyl ester, (E)-(139284-99-4)

  • 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: 139284-99-4(Hazardous Substances Data)

139284-99-4 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 139284-99-4 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,3,9,2,8 and 4 respectively; the second part has 2 digits, 9 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 139284-99:
(8*1)+(7*3)+(6*9)+(5*2)+(4*8)+(3*4)+(2*9)+(1*9)=164
164 % 10 = 4
So 139284-99-4 is a valid CAS Registry Number.

139284-99-4SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name methyl (E)-3-[1-(p-toluenesulfonyl)-1H-imidazol-4(5)-yl]propenoate

1.2 Other means of identification

Product number -
Other names -

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:139284-99-4 SDS

139284-99-4Relevant articles and documents

The design of potent, selective, non-covalent, peptide thrombin inhibitors utilizing imidazole as a S1 binding element

Wiley, Michael R.,Weir, Leonard C.,Briggs, Steven L.,Chirgadze, Nickolay Y.,Clawson, David,Gifford-Moore, Donetta S.,Schacht, Aaron L.,Smith, Gerald F.,Vasudevan, Vasu,Zornes, Larry L.,Klimkowski, Valentine J.

, p. 2767 - 2772 (1999)

Modeling of neutral or mildly basic functional groups in the S1 site of thrombin led to the targeting of imidazole as a S1 binding element and correctly predicted the optimal chain length for connecting this group with the S2 and S3 binding elements. Deri

Diels-Alder Reaction of (E)-4-(2-Nitroethenyl)-1H-imidazoles and Methyl (E)-3-(1-Imidazol-4-yl)propenoates

Kosaka, Keigo,Maruyama, Kazumi,Nakamura, Haruko,Ikeda, Masazumi

, p. 1941 - 1944 (2007/10/02)

Diels-Alder reaction of methyl (E)-3-(1H-imidazol-4-yl)propenoates 2, 3a-c and (E)-4-(2-nitroethenyl)-1H-imidazoles 3d,e with 2,3-dimethyl-1,3-butadiene, cyclopentadiene, and cyclohexa-1,3-diene gave the corresponding cycloadducts 6-9.

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