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Home Halogens 2-Acetyl-3-bromothiophene

2-Acetyl-3-bromothiophene

CAS No.:
42877-08-7
Catalog Number:
AG00C0ET
Molecular Formula:
C6H5BrOS
Molecular Weight:
205.0723
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
97%
In Stock USA
United States
$43
- +
10g
97%
In Stock USA
United States
$80
- +
25g
97%
In Stock USA
United States
$148
- +
100g
97%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG00C0ET
Chemical Name:
2-Acetyl-3-bromothiophene
CAS Number:
42877-08-7
Molecular Formula:
C6H5BrOS
Molecular Weight:
205.0723
MDL Number:
MFCD00794287
IUPAC Name:
1-(3-bromothiophen-2-yl)ethanone
InChI:
InChI=1S/C6H5BrOS/c1-4(8)6-5(7)2-3-9-6/h2-3H,1H3
InChI Key:
ZUXPELAHJQSZTE-UHFFFAOYSA-N
SMILES:
CC(=O)c1sccc1Br
Properties
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.924g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.069g/mol
Monoisotopic Mass:
203.924g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
(2E)-3-(1,3-Benzodioxol-5-yl)-1-(3-bromo-2-thien-yl)prop-2-en-1-one. Acta crystallographica. Section E, Structure reports online 20101001
1-(3-Bromo-2-thien-yl)ethanone. Acta crystallographica. Section E, Structure reports online 20101001
Properties