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3-Bromo-2，4-dimethylthiophene - ≥95%, high purity , CAS No.79485-96-4

COA

Grade & Purity:

≥95%

Cas Number: 79485-96-4
Molecular Weight: 191.1
PubChem CID: 10631774

In stock

Item Number

B724911

Grouped product items
SKU	Size	Availability	Price	Qty
B724911-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$554.90

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
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

Names and Identifiers

IUPAC Name	3-bromo-2,4-dimethylthiophene
INCHI	InChI=1S/C6H7BrS/c1-4-3-8-5(2)6(4)7/h3H,1-2H3
InChIKey	FJAWMIOGPDVYID-UHFFFAOYSA-N
Smiles	CC1=CSC(=C1Br)C
Isomeric SMILES	CC1=CSC(=C1Br)C
PubChem CID	10631774
Molecular Weight	191.1

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	191.090 g/mol
XLogP3	3.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	189.945 Da
Monoisotopic Mass	189.945 Da
Topological Polar Surface Area	28.200 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	84.600
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

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