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Home > Fluorides > 168130-88-9
168130-88-9 | 2,2,3,3,3-Pentafluoro-1-thiophene-2-yl-propane-1-ol
CAS No: 168130-88-9 Catalog No: AG01F2AW MDL No:MFCD04116453
Product Description
Catalog Number:
AG01F2AW
Chemical Name:
2,2,3,3,3-Pentafluoro-1-thiophene-2-yl-propane-1-ol
CAS Number:
168130-88-9
Molecular Formula:
C7H5F5OS
Molecular Weight:
232.1710
MDL Number:
MFCD04116453
IUPAC Name:
2,2,3,3,3-pentafluoro-1-thiophen-2-ylpropan-1-ol
InChI:
InChI=1S/C7H5F5OS/c8-6(9,7(10,11)12)5(13)4-2-1-3-14-4/h1-3,5,13H
InChI Key:
NNDMXHLSCSOUPG-UHFFFAOYSA-N
SMILES:
OC(C(C(F)(F)F)(F)F)c1cccs1
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.998g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.168g/mol
Monoisotopic Mass:
231.998g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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