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265652-36-6

265652-36-6 | 2-Thiophenecarbonyl chloride, 4-bromo-3-methyl-

CAS No: 265652-36-6 Catalog No: AG002TPM MDL No:MFCD03265447

Product Description

Catalog Number:
AG002TPM
Chemical Name:
2-Thiophenecarbonyl chloride, 4-bromo-3-methyl-
CAS Number:
265652-36-6
Molecular Formula:
C6H4BrClOS
Molecular Weight:
239.5174
MDL Number:
MFCD03265447
IUPAC Name:
4-bromo-3-methylthiophene-2-carbonyl chloride
InChI:
InChI=1S/C6H4BrClOS/c1-3-4(7)2-10-5(3)6(8)9/h2H,1H3
InChI Key:
LQDVGTOWGBSXPJ-UHFFFAOYSA-N
SMILES:
ClC(=O)c1scc(c1C)Br

Properties

Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.885g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.511g/mol
Monoisotopic Mass:
237.885g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

Literature

Title Journal
Development of potential manufacturing routes for substituted thiophenes--preparation of halogenated 2-thiophenecarboxylic acid derivatives as building blocks for a new family of 2,6-dihaloaryl 1,2,4-triazole insecticides. Beilstein journal of organic chemistry 20070101

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