Home Sulfos 3-(trifluoromethylsulfonyloxy)prop-1-yne

3-(trifluoromethylsulfonyloxy)prop-1-yne

CAS No.:
41029-46-3
Catalog Number:
AG01EMSH
Molecular Formula:
C4H3F3O3S
Molecular Weight:
188.1250
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Product Description
Catalog Number:
AG01EMSH
Chemical Name:
3-(trifluoromethylsulfonyloxy)prop-1-yne
CAS Number:
41029-46-3
Molecular Formula:
C4H3F3O3S
Molecular Weight:
188.1250
MDL Number:
MFCD17013369
IUPAC Name:
prop-2-ynyl trifluoromethanesulfonate
InChI:
InChI=1S/C4H3F3O3S/c1-2-3-10-11(8,9)4(5,6)7/h1H,3H2
InChI Key:
ROQYGSVHXLIXGO-UHFFFAOYSA-N
SMILES:
C#CCOS(=O)(=O)C(F)(F)F
Properties
Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.975g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.12g/mol
Monoisotopic Mass:
187.975g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties