Home Other Building Blocks (3-(Trifluoromethyl)phenyl)methanethiol

(3-(Trifluoromethyl)phenyl)methanethiol

CAS No.:
25697-55-6
Catalog Number:
AG003CRA
Molecular Formula:
C8H7F3S
Molecular Weight:
192.2014
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$125
- +
5g
95%
In Stock USA
United States
$154
- +
Product Description
Catalog Number:
AG003CRA
Chemical Name:
(3-(Trifluoromethyl)phenyl)methanethiol
CAS Number:
25697-55-6
Molecular Formula:
C8H7F3S
Molecular Weight:
192.2014
MDL Number:
MFCD00042435
IUPAC Name:
[3-(trifluoromethyl)phenyl]methanethiol
InChI:
InChI=1S/C8H7F3S/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-4,12H,5H2
InChI Key:
CQIQWIMXCPTQPJ-UHFFFAOYSA-N
SMILES:
SCc1cccc(c1)C(F)(F)F
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.022g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.199g/mol
Monoisotopic Mass:
192.022g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties