Home Other Building Blocks 5-(Trifluoromethyl)-2(3H)-benzoxazolethione

5-(Trifluoromethyl)-2(3H)-benzoxazolethione

CAS No.:
13451-80-4
Catalog Number:
AG00AJAD
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00AJAD
Chemical Name:
5-(Trifluoromethyl)-2(3H)-benzoxazolethione
CAS Number:
13451-80-4
MDL Number:
MFCD00598871
IUPAC Name:
5-(trifluoromethyl)-3H-1,3-benzoxazole-2-thione
InChI:
InChI=1S/C8H4F3NOS/c9-8(10,11)4-1-2-6-5(3-4)12-7(14)13-6/h1-3H,(H,12,14)
InChI Key:
MBQRNNRGEFJOFN-UHFFFAOYSA-N
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.997g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.181g/mol
Monoisotopic Mass:
218.997g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties