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Home > Fluorides > 127256-73-9
127256-73-9 | 2-Butanol, 1,1,1,3,3,4,4,4-octafluoro-
CAS No: 127256-73-9 Catalog No: AG000WTW MDL No:
Product Description
Catalog Number:
AG000WTW
Chemical Name:
2-Butanol, 1,1,1,3,3,4,4,4-octafluoro-
CAS Number:
127256-73-9
Molecular Formula:
C4H2F8O
Molecular Weight:
218.0453
IUPAC Name:
1,1,1,3,3,4,4,4-octafluorobutan-2-ol
InChI:
InChI=1S/C4H2F8O/c5-2(6,4(10,11)12)1(13)3(7,8)9/h1,13H
InChI Key:
ZVXAXABPTOPGDK-UHFFFAOYSA-N
SMILES:
OC(C(C(F)(F)F)(F)F)C(F)(F)F
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.998g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.046g/mol
Monoisotopic Mass:
217.998g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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