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Home Halogens 1-(4-bromophenyl)-2-(pyridin-2-ylthio)ethanone

1-(4-bromophenyl)-2-(pyridin-2-ylthio)ethanone

CAS No.:
5898-19-1
Catalog Number:
AG00EC12
Molecular Formula:
C13H10BrNOS
Molecular Weight:
308.1936
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$64
- +
5g
95%
In Stock USA
United States
$125
- +
Product Description
Catalog Number:
AG00EC12
Chemical Name:
1-(4-bromophenyl)-2-(pyridin-2-ylthio)ethanone
CAS Number:
5898-19-1
Molecular Formula:
C13H10BrNOS
Molecular Weight:
308.1936
MDL Number:
MFCD00442971
IUPAC Name:
1-(4-bromophenyl)-2-pyridin-2-ylsulfanylethanone
InChI:
InChI=1S/C13H10BrNOS/c14-11-6-4-10(5-7-11)12(16)9-17-13-3-1-2-8-15-13/h1-8H,9H2
InChI Key:
GUGVDLUPWKIBQU-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)C(=O)CSc1ccccn1
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.967g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.193g/mol
Monoisotopic Mass:
306.967g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties