Home Sulfos 3-Trifluoromethanesulfonyloxy-but-2-enoic acid methyl ester

3-Trifluoromethanesulfonyloxy-but-2-enoic acid methyl ester

CAS No.:
133559-43-0
Catalog Number:
AG009B8W
Molecular Formula:
C6H7F3O5S
Molecular Weight:
248.1770
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$62
- +
5g
98%
In Stock USA
United States
$185
- +
10g
98%
In Stock USA
United States
$300
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG009B8W
Chemical Name:
3-Trifluoromethanesulfonyloxy-but-2-enoic acid methyl ester
CAS Number:
133559-43-0
Molecular Formula:
C6H7F3O5S
Molecular Weight:
248.1770
MDL Number:
MFCD03001758
IUPAC Name:
methyl (Z)-3-(trifluoromethylsulfonyloxy)but-2-enoate
InChI:
InChI=1S/C6H7F3O5S/c1-4(3-5(10)13-2)14-15(11,12)6(7,8)9/h3H,1-2H3/b4-3-
InChI Key:
RSNDRPHGOLGQLG-ARJAWSKDSA-N
SMILES:
COC(=O)/C=C(/OS(=O)(=O)C(F)(F)F)\C
Properties
Complexity:
361  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
247.997g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.172g/mol
Monoisotopic Mass:
247.997g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
78A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties