2,4-Dibromothiophene - ≥90% , CAS No.3140-92-9

CAS: 3140-92-9 Cat. No.: D136154 Formula: C₄H₂Br₂S Molecular Weight: 241.93 EC Number: 678-717-9

GRADE & PURITY ≥90%

Synonyms

2,4-DIBROMO THIOPHENE | DTXSID20185323 | InChI=1/C4H2Br2S/c5-3-1-4(6)7-2-3/h1-2 | PS-3361 | AKOS005216735 | SY031539 | MFCD00043889 | SCHEMBL422305 | 2,4-Dibromothiophene | A5690 | AMY2556 | STL557588 | BBL103778 | FT-0609994 | J-507107 | Thiophene, 2,4-d

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Overview

2,4-Dibromothiophene is used as an important raw material and intermediate used in organic Synthesis, pharmaceuticals, agrochemicals and dyestuff. It is also used as an intermediate in organic synthesis.

Specifications

Synonyms

2,4-DIBROMO THIOPHENE | DTXSID20185323 | InChI=1/C4H2Br2S/c5-3-1-4(6)7-2-3/h1-2 | PS-3361 | AKOS005216735 | SY031539 | MFCD00043889 | SCHEMBL422305 | 2,4-Dibromothiophene | A5690 | AMY2556 | STL557588 | BBL103778 | FT-0609994 | J-507107 | Thiophene, 2,4-d

Specifications & Purity

≥90%

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥90%

Names and Identifiers

• Pubchem Sid: 504760900
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504760900
• Canonical Smiles: C1=C(SC=C1Br)Br
• IUPAC Name: 2,4-dibromothiophene
• InChIKey: WAQFYSJKIRRXLP-UHFFFAOYSA-N
• INCHI: 1S/C4H2Br2S/c5-3-1-4(6)7-2-3/h1-2H
• Isomeric SMILES: C1=C(SC=C1Br)Br
• WGK Germany: 3
• Molecular Weight: 241.93
• Reaxy-Rn: 107651
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=107651&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Class Aryl halides
      • Subclass Aryl bromides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Class: Aryl halides
• Subclass: Aryl bromides
• Intermediate Tree Nodes: Not available
• Direct Parent: Aryl bromides
• Alternative Parents: Thiophenes Heteroaromatic compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aryl bromide - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Hydrocarbon derivative - Organobromide - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as aryl bromides. These are organic compounds containing the acyl bromide functional group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Solubility: It is insoluble in water.
• Sensitivity: Air & Heat sensitive
• Refractive Index: 1.632
• Flash Point(°F): >230 °F
• Flash Point(°C): >110 °C
• Boil Point(°C): 97 °C/10 mmHg
• Molecular Weight: 241.930 g/mol
• XLogP3: 3.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 241.822 Da
• Monoisotopic Mass: 239.824 Da
• Topological Polar Surface Area: 28.200 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 66.700
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Frequently Asked Questions

What is the purity of this product?

This product is supplied at ≥90% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 3140-92-9, the molecular formula is C4H2Br2S, and the molecular weight is 241.93 g/mol. InChIKey WAQFYSJKIRRXLP-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.