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Home > Fluorides > 114810-56-9
114810-56-9 | 1-Pentanol, 4,5,5,5-tetrafluoro-2-iodo-4-(trifluoromethyl)-
CAS No: 114810-56-9 Catalog No: AG000F9J MDL No:MFCD4039189
Product Description
Catalog Number:
AG000F9J
Chemical Name:
1-Pentanol, 4,5,5,5-tetrafluoro-2-iodo-4-(trifluoromethyl)-
CAS Number:
114810-56-9
Molecular Formula:
C6H6F7IO
Molecular Weight:
354.0045
MDL Number:
MFCD4039189
IUPAC Name:
4,5,5,5-tetrafluoro-2-iodo-4-(trifluoromethyl)pentan-1-ol
InChI:
InChI=1S/C6H6F7IO/c7-4(5(8,9)10,6(11,12)13)1-3(14)2-15/h3,15H,1-2H2
InChI Key:
VCOYOPKEJYAJCN-UHFFFAOYSA-N
SMILES:
OCC(CC(C(F)(F)F)(C(F)(F)F)F)I
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.935g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
354.006g/mol
Monoisotopic Mass:
353.935g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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