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Home Halogens Thiophene, 2-bromo-4-hexyl-

Thiophene, 2-bromo-4-hexyl-

CAS No.:
210705-84-3
Catalog Number:
AG002KX9
Molecular Formula:
C10H15BrS
Molecular Weight:
247.1951
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>98.0%(GC)
1 week
United States
$196
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Product Description
Catalog Number:
AG002KX9
Chemical Name:
Thiophene, 2-bromo-4-hexyl-
CAS Number:
210705-84-3
Molecular Formula:
C10H15BrS
Molecular Weight:
247.1951
MDL Number:
MFCD18413571
IUPAC Name:
2-bromo-4-hexylthiophene
InChI:
InChI=1S/C10H15BrS/c1-2-3-4-5-6-9-7-10(11)12-8-9/h7-8H,2-6H2,1H3
InChI Key:
IKXKKFNSZQNRFR-UHFFFAOYSA-N
SMILES:
CCCCCCc1csc(c1)Br
Properties
Complexity:
116  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.008g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.194g/mol
Monoisotopic Mass:
246.008g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6  
Literature
Title Journal
A case report of acute dermatitis that developed during an experiment examining the bromination of 3-hexylthiophene. Journal of occupational medicine and toxicology (London, England) 20100101
Properties