Home Halogens 6-bromo-3-chloro-1,2-benzothiazole

6-bromo-3-chloro-1,2-benzothiazole

CAS No.:
1427081-05-7
Catalog Number:
AG01BA1V
Molecular Formula:
C7H3BrClNS
Molecular Weight:
248.5274
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Product Description
Catalog Number:
AG01BA1V
Chemical Name:
6-bromo-3-chloro-1,2-benzothiazole
CAS Number:
1427081-05-7
Molecular Formula:
C7H3BrClNS
Molecular Weight:
248.5274
MDL Number:
MFCD24368700
IUPAC Name:
6-bromo-3-chloro-1,2-benzothiazole
InChI:
InChI=1S/C7H3BrClNS/c8-4-1-2-5-6(3-4)11-10-7(5)9/h1-3H
InChI Key:
WTUXIIFLIZPNRS-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)snc2Cl
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.886g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.522g/mol
Monoisotopic Mass:
246.886g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties