Home Halogens 6-bromo-4-fluoro-2-methyl-1,3-benzothiazole

6-bromo-4-fluoro-2-methyl-1,3-benzothiazole

CAS No.:
1427433-65-5
Catalog Number:
AG01BDR4
Molecular Formula:
C8H5BrFNS
Molecular Weight:
246.0994
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Product Description
Catalog Number:
AG01BDR4
Chemical Name:
6-bromo-4-fluoro-2-methyl-1,3-benzothiazole
CAS Number:
1427433-65-5
Molecular Formula:
C8H5BrFNS
Molecular Weight:
246.0994
MDL Number:
MFCD23705829
IUPAC Name:
6-bromo-4-fluoro-2-methyl-1,3-benzothiazole
InChI:
InChI=1S/C8H5BrFNS/c1-4-11-8-6(10)2-5(9)3-7(8)12-4/h2-3H,1H3
InChI Key:
BRJHPBPSYPUGCM-UHFFFAOYSA-N
SMILES:
Brc1cc(F)c2c(c1)sc(n2)C
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.931g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.097g/mol
Monoisotopic Mass:
244.931g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties