Home Sulfos 3-Trifluoromethylphenylsulfonylethanol

3-Trifluoromethylphenylsulfonylethanol

CAS No.:
548739-95-3
Catalog Number:
AG01EWFE
Molecular Formula:
C9H9F3O3S
Molecular Weight:
254.2262
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
1 week
United States
$323
- +
5g
98%
1 week
United States
$892
- +
25g
98%
1 week
United States
$2594
- +
Product Description
Catalog Number:
AG01EWFE
Chemical Name:
3-Trifluoromethylphenylsulfonylethanol
CAS Number:
548739-95-3
Molecular Formula:
C9H9F3O3S
Molecular Weight:
254.2262
MDL Number:
MFCD03789217
IUPAC Name:
2-[3-(trifluoromethyl)phenyl]sulfonylethanol
InChI:
InChI=1S/C9H9F3O3S/c10-9(11,12)7-2-1-3-8(6-7)16(14,15)5-4-13/h1-3,6,13H,4-5H2
InChI Key:
KJRBWTNOMDULTR-UHFFFAOYSA-N
SMILES:
OCCS(=O)(=O)c1cccc(c1)C(F)(F)F
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.022g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
254.223g/mol
Monoisotopic Mass:
254.022g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties