Home Other Building Blocks 3-(Trifluoromethyl)thiophenol

3-(Trifluoromethyl)thiophenol

CAS No.:
937-00-8
Catalog Number:
AG0033HD
Molecular Formula:
C7H5F3S
Molecular Weight:
178.1748
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$38
- +
5g
95%
In Stock USA
United States
$150
- +
Product Description
Catalog Number:
AG0033HD
Chemical Name:
3-(Trifluoromethyl)thiophenol
CAS Number:
937-00-8
Molecular Formula:
C7H5F3S
Molecular Weight:
178.1748
MDL Number:
MFCD00041142
IUPAC Name:
3-(trifluoromethyl)benzenethiol
InChI:
InChI=1S/C7H5F3S/c8-7(9,10)5-2-1-3-6(11)4-5/h1-4,11H
InChI Key:
SCURCOWZQJIUGR-UHFFFAOYSA-N
SMILES:
Sc1cccc(c1)C(F)(F)F
NSC Number:
88281
Properties
Complexity:
132  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.006g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.172g/mol
Monoisotopic Mass:
178.006g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties