Home Other Building Blocks 2-Amino-6-(trifluoro-methylsufanyl)benzothiazole

2-Amino-6-(trifluoro-methylsufanyl)benzothiazole

CAS No.:
326-45-4
Catalog Number:
AG00C05B
Molecular Formula:
C8H5F3N2S2
Molecular Weight:
250.2639
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00C05B
Chemical Name:
2-Amino-6-(trifluoro-methylsufanyl)benzothiazole
CAS Number:
326-45-4
Molecular Formula:
C8H5F3N2S2
Molecular Weight:
250.2639
MDL Number:
MFCD00665748
IUPAC Name:
6-(trifluoromethylsulfanyl)-1,3-benzothiazol-2-amine
InChI:
InChI=1S/C8H5F3N2S2/c9-8(10,11)15-4-1-2-5-6(3-4)14-7(12)13-5/h1-3H,(H2,12,13)
InChI Key:
PBRVVEXJMLEKMJ-UHFFFAOYSA-N
SMILES:
Nc1nc2c(s1)cc(cc2)SC(F)(F)F
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.985g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.257g/mol
Monoisotopic Mass:
249.985g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties