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Home > Fluorides > 120030-78-6
120030-78-6 | 1,2,4-Trioxolane, 3,3,5-trifluoro-5-(trifluoromethyl)-
CAS No: 120030-78-6 Catalog No: AG000Q5A MDL No:
Product Description
Catalog Number:
AG000Q5A
Chemical Name:
1,2,4-Trioxolane, 3,3,5-trifluoro-5-(trifluoromethyl)-
CAS Number:
120030-78-6
Molecular Formula:
C3F6O3
Molecular Weight:
198.0207
IUPAC Name:
3,3,5-trifluoro-5-(trifluoromethyl)-1,2,4-trioxolane
InChI:
InChI=1S/C3F6O3/c4-1(5,6)2(7)10-3(8,9)12-11-2
InChI Key:
VSNOADUWTAMOSU-UHFFFAOYSA-N
SMILES:
FC1(F)OOC(O1)(F)C(F)(F)F
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.975g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.02g/mol
Monoisotopic Mass:
197.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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