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Home > Fluorides > 116020-01-0
116020-01-0 | 2-Oxetanol, 3,3-difluoro-4-phenyl-2-(trifluoromethyl)-
CAS No: 116020-01-0 Catalog No: AG000BDQ MDL No:
Product Description
Catalog Number:
AG000BDQ
Chemical Name:
2-Oxetanol, 3,3-difluoro-4-phenyl-2-(trifluoromethyl)-
CAS Number:
116020-01-0
Molecular Formula:
C10H7F5O2
Molecular Weight:
254.1534
IUPAC Name:
3,3-difluoro-4-phenyl-2-(trifluoromethyl)oxetan-2-ol
InChI:
InChI=1S/C10H7F5O2/c11-8(12)7(6-4-2-1-3-5-6)17-9(8,16)10(13,14)15/h1-5,7,16H
InChI Key:
GAMSRTZMGQLDAS-UHFFFAOYSA-N
SMILES:
FC(C1(O)OC(C1(F)F)c1ccccc1)(F)F
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.037g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.156g/mol
Monoisotopic Mass:
254.037g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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