(S)-(-)-1,1,1-Trifluorooctan-2-ol - CAS 129443-08-9
Catalog: |
BB050249 |
Product Name: |
(S)-(-)-1,1,1-Trifluorooctan-2-ol |
CAS: |
129443-08-9 |
Synonyms: |
(S)-1,1,1-Trifluorooctan-2-ol; (S)-(-)-1,1,1-Trifluoro-2-octanol |
IUPAC Name: | (2S)-1,1,1-trifluorooctan-2-ol |
Description: | (S)-(-)-1,1,1-Trifluorooctan-2-ol (CAS# 129443-08-9 ) is a useful research chemical. |
Molecular Weight: | 184.2 |
Molecular Formula: | C8H15F3O |
Canonical SMILES: | CCCCCCC(C(F)(F)F)O |
InChI: | InChI=1S/C8H15F3O/c1-2-3-4-5-6-7(12)8(9,10)11/h7,12H,2-6H2,1H3/t7-/m0/s1 |
InChI Key: | INAIBHXNHIEDAM-ZETCQYMHSA-N |
Boiling Point: | 192.4 °C at 760 mmHg |
Purity: | 95 % |
Density: | 1.05 g/mL at 25 °C(lit.) |
Appearance: | Liquid |
Complexity: | 111 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.10749958 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.10749958 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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