Home Other Building Blocks 4-(trifluoromethyl)-2,3-dihydro-1lambda6-thiophene-1,1-dione

4-(trifluoromethyl)-2,3-dihydro-1lambda6-thiophene-1,1-dione

CAS No.:
71654-37-0
Catalog Number:
AG01EMUL
Molecular Formula:
C5H5F3O2S
Molecular Weight:
186.1522
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Product Description
Catalog Number:
AG01EMUL
Chemical Name:
4-(trifluoromethyl)-2,3-dihydro-1lambda6-thiophene-1,1-dione
CAS Number:
71654-37-0
Molecular Formula:
C5H5F3O2S
Molecular Weight:
186.1522
MDL Number:
MFCD31615503
IUPAC Name:
4-(trifluoromethyl)-2,3-dihydrothiophene 1,1-dioxide
InChI:
InChI=1S/C5H5F3O2S/c6-5(7,8)4-1-2-11(9,10)3-4/h3H,1-2H2
InChI Key:
GCXNRMNVCUPWMJ-UHFFFAOYSA-N
SMILES:
FC(C1=CS(=O)(=O)CC1)(F)F
Properties
Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.996g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.148g/mol
Monoisotopic Mass:
185.996g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties