Home Other Building Blocks 2,5,6-TRICHLOROBENZOTHIAZOLE

2,5,6-TRICHLOROBENZOTHIAZOLE

CAS No.:
120258-61-9
Catalog Number:
AG008WK2
Molecular Formula:
C7H2Cl3NS
Molecular Weight:
238.5215
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Product Description
Catalog Number:
AG008WK2
Chemical Name:
2,5,6-TRICHLOROBENZOTHIAZOLE
CAS Number:
120258-61-9
Molecular Formula:
C7H2Cl3NS
Molecular Weight:
238.5215
MDL Number:
MFCD09749269
IUPAC Name:
2,5,6-trichloro-1,3-benzothiazole
InChI:
InChI=1S/C7H2Cl3NS/c8-3-1-5-6(2-4(3)9)12-7(10)11-5/h1-2H
InChI Key:
WNVSIKFDDOOWGR-UHFFFAOYSA-N
SMILES:
Clc1sc2c(n1)cc(c(c2)Cl)Cl
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.897g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.51g/mol
Monoisotopic Mass:
236.897g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties