Home Halogens 2-chloro-4-((trifluoromethyl)thio)phenol

2-chloro-4-((trifluoromethyl)thio)phenol

CAS No.:
70783-74-3
Catalog Number:
AG01CA5D
Molecular Formula:
C7H4ClF3OS
Molecular Weight:
228.6193
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01CA5D
Chemical Name:
2-chloro-4-((trifluoromethyl)thio)phenol
CAS Number:
70783-74-3
Molecular Formula:
C7H4ClF3OS
Molecular Weight:
228.6193
MDL Number:
MFCD25966444
IUPAC Name:
2-chloro-4-(trifluoromethylsulfanyl)phenol
InChI:
InChI=1S/C7H4ClF3OS/c8-5-3-4(1-2-6(5)12)13-7(9,10)11/h1-3,12H
InChI Key:
OHGJQHWYVINODI-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1Cl)SC(F)(F)F
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.962g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
228.613g/mol
Monoisotopic Mass:
227.962g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties