Home Other Building Blocks 2-[(trifluoromethyl)sulfanyl]phenol

2-[(trifluoromethyl)sulfanyl]phenol

CAS No.:
33185-56-7
Catalog Number:
AG01A84L
Molecular Formula:
C7H5F3OS
Molecular Weight:
194.1742
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Product Description
Catalog Number:
AG01A84L
Chemical Name:
2-[(trifluoromethyl)sulfanyl]phenol
CAS Number:
33185-56-7
Molecular Formula:
C7H5F3OS
Molecular Weight:
194.1742
MDL Number:
MFCD15209618
IUPAC Name:
2-(trifluoromethylsulfanyl)phenol
InChI:
InChI=1S/C7H5F3OS/c8-7(9,10)12-6-4-2-1-3-5(6)11/h1-4,11H
InChI Key:
QIVDFUUJJILMTQ-UHFFFAOYSA-N
SMILES:
Oc1ccccc1SC(F)(F)F
Properties
Complexity:
148  
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