Home Other Building Blocks 4-(Trifluoromethylthio)phenol

4-(Trifluoromethylthio)phenol

CAS No.:
461-84-7
Catalog Number:
AG0033UC
Molecular Formula:
C7H5F3OS
Molecular Weight:
194.1742
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$25
- +
25g
≥98%
In Stock USA
United States
$75
- +
500g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG0033UC
Chemical Name:
4-(Trifluoromethylthio)phenol
CAS Number:
461-84-7
Molecular Formula:
C7H5F3OS
Molecular Weight:
194.1742
MDL Number:
MFCD00036035
IUPAC Name:
4-(trifluoromethylsulfanyl)phenol
InChI:
InChI=1S/C7H5F3OS/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4,11H
InChI Key:
YYCPTWHVKSATQK-UHFFFAOYSA-N
SMILES:
FC(Sc1ccc(cc1)O)(F)F
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.001g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.171g/mol
Monoisotopic Mass:
194.001g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties