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5-Nitrobenzo[b]thiophene-2-carboxaldehyde is an organic compound characterized by its molecular formula C9H5NO3S2. This chemical features a benzene ring fused to a thiophene ring, with a nitro group (-NO2) attached at the 5-position of the benzene ring. The molecule also contains a formyl group (-CHO) at the 2-position of the thiophene ring, indicating the presence of an aldehyde functional group. 5-Nitrobenzothiophene-2-carboxaldehyde is known for its potential applications in the synthesis of various pharmaceuticals and other organic compounds due to its unique structure and reactivity. It is typically used as an intermediate in chemical reactions, where its nitro and aldehyde groups can be further modified to produce a range of derivatives.

4688-16-8

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  • 4688-16-8 Structure
  • Basic information

    1. Product Name: 5-Nitrobenzothiophene-2-carboxaldehyde
    2. Synonyms: 5-Nitrobenzothiophene-2-carboxaldehyde
    3. CAS NO:4688-16-8
    4. Molecular Formula:
    5. Molecular Weight: 207.21
    6. EINECS: N/A
    7. Product Categories: N/A
  • 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: 5-Nitrobenzothiophene-2-carboxaldehyde(CAS DataBase Reference)
    10. NIST Chemistry Reference: 5-Nitrobenzothiophene-2-carboxaldehyde(4688-16-8)
    11. EPA Substance Registry System: 5-Nitrobenzothiophene-2-carboxaldehyde(4688-16-8)
  • 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: 4688-16-8(Hazardous Substances Data)

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4688-16-8 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 4688-16-8 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,6,8 and 8 respectively; the second part has 2 digits, 1 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 4688-16:
(6*4)+(5*6)+(4*8)+(3*8)+(2*1)+(1*6)=118
118 % 10 = 8
So 4688-16-8 is a valid CAS Registry Number.

4688-16-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 5-Nitro-1-benzothiophene-2-carbaldehyde

1.2 Other means of identification

Product number -
Other names 5-Nitrobenzo<b>thiophene-2-carboxaldehyde

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:4688-16-8 SDS

4688-16-8Relevant academic research and scientific papers

THERAPEUTIC USES OF INHIBITORS OF THE RNA-BINDING PROTEIN HUR

-

Paragraph 0083, (2021/10/11)

The present technology is directed to methods of treatment utilizing inhibitors of HuR interaction with RNA, where the inhibitors are of Formula I where R1 is; and X1 is OH, NH-OH, or 0-(C1-C8 unsubstituted alkyl).

HETEROARYL COMPOUNDS AS INHIBITORS OF PROGRAMMED NECROSIS PATHWAY, COMPOSITION AND METHOD USING THE SAME

-

Paragraph 00168; 00171-00172, (2021/07/10)

The present disclosure provides heteroaryl compounds of Formula (I), processes for their preparation, pharmaceutical compositions containing them, and their use in the treatment of diseases and disorders, arising from or related to the programmed necrosis pathway.

A straightforward expeditious synthesis of 5-nitrobenzo[b]thiophene-2- carbaldehyde

Wei, Hongtao,Sun, Min,Ji, Min

scheme or table, p. 359 - 360 (2009/12/07)

A high yielding one-pot synthesis of 5-nitrobenzo[b]thiophene-2- carbaldehyde is reported using the readily available,cheap starting material 2,5-dihydroxy-1,4-dithiane and 2-chloro-5-nitrobenzaldehyde.

2-Substituted 5-Nitrobenzothiophene Derivatives with Biological Activity

Fakhr, I. M. I.,Zayed, S. M. A. D.,Fathy, A. M.

, p. 757 - 768 (2007/10/03)

5-Nitrobenzothiophene-2-carboxaldehyde (I) reacted readily with compounds having an active methylene group in basic medium to give a variety of condensation products (IVa-g). The β-benzothiophenyl acrylic acid derivative (IVa) could also be prepared by heating the aldehyde (I) with acetic anhydride in presence of anhydrous sodium acetate. Its methyl ester (Vb) yielded upon condensation with hydroxylamine hydrochloride in alkaline medium the hydroxamic acid (VI). When (I) was reacted with acetyl glycine in presence of acetic anhydride, the azalactone derivative (IVe) was obtained, which upon heating with water was hydrolyzed to (IVf). The aldehyde (I) underwent readily Cross-Aldol condensation with acetaldehyde and/or acetone in alkaline medium to give the α,β-unsaturated carbonyl compounds (IVh) and (IVi), respectively.

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