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Home Halogens 1-(1,3-Benzothiazol-2-yl)-2-bromo-1-ethanone

1-(1,3-Benzothiazol-2-yl)-2-bromo-1-ethanone

CAS No.:
54223-20-0
Catalog Number:
AG00I9OM
Molecular Formula:
C9H6BrNOS
Molecular Weight:
256.1190
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$150
- +
1g
95%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG00I9OM
Chemical Name:
1-(1,3-Benzothiazol-2-yl)-2-bromo-1-ethanone
CAS Number:
54223-20-0
Molecular Formula:
C9H6BrNOS
Molecular Weight:
256.1190
MDL Number:
MFCD03659698
IUPAC Name:
1-(1,3-benzothiazol-2-yl)-2-bromoethanone
InChI:
InChI=1S/C9H6BrNOS/c10-5-7(12)9-11-6-3-1-2-4-8(6)13-9/h1-4H,5H2
InChI Key:
AYWGYNKWZWBMSV-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1nc2c(s1)cccc2
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.935g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.117g/mol
Monoisotopic Mass:
254.935g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties