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Home > Fluorides > 147991-84-2
147991-84-2 | 2-Nonanol, 1,1,1-trifluoro-, (2S)-
CAS No: 147991-84-2 Catalog No: AG001FCJ MDL No:MFCD06799353
Product Description
Catalog Number:
AG001FCJ
Chemical Name:
2-Nonanol, 1,1,1-trifluoro-, (2S)-
CAS Number:
147991-84-2
Molecular Formula:
C9H17F3O
Molecular Weight:
198.2259
MDL Number:
MFCD06799353
IUPAC Name:
(2S)-1,1,1-trifluorononan-2-ol
InChI:
InChI=1S/C9H17F3O/c1-2-3-4-5-6-7-8(13)9(10,11)12/h8,13H,2-7H2,1H3/t8-/m0/s1
InChI Key:
ZPKPJIUKYONDSL-QMMMGPOBSA-N
SMILES:
CCCCCCC[C@@H](C(F)(F)F)O
Properties
Complexity:
123
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
198.123g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.229g/mol
Monoisotopic Mass:
198.123g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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