1-Cyclohexyl-2,2,2-trifluoroethanol - CAS 107018-38-2
Catalog: |
BB001958 |
Product Name: |
1-Cyclohexyl-2,2,2-trifluoroethanol |
CAS: |
107018-38-2 |
Synonyms: |
1-cyclohexyl-2,2,2-trifluoroethanol; 1-cyclohexyl-2,2,2-trifluoroethanol |
IUPAC Name: | 1-cyclohexyl-2,2,2-trifluoroethanol |
Description: | 1-Cyclohexyl-2,2,2-trifluoroethanol (CAS# 107018-38-2 ) is a useful research chemical. |
Molecular Weight: | 182.18 |
Molecular Formula: | C8H13F3O |
Canonical SMILES: | C1CCC(CC1)C(C(F)(F)F)O |
InChI: | InChI=1S/C8H13F3O/c9-8(10,11)7(12)6-4-2-1-3-5-6/h6-7,12H,1-5H2 |
InChI Key: | WDWKMZMIJJTUES-UHFFFAOYSA-N |
LogP: | 2.48990 |
Publication Number | Title | Priority Date |
US-2021171500-A1 | Triazole carbamate pyridyl sulfonamides as lpa receptor antagonists and uses thereof | 20191115 |
EP-3359532-A1 | Biaryl pyrazoles as nrf2 regulators | 20151006 |
JP-2018529745-A | Biarylpyrazoles as NRF2 regulators | 20151006 |
US-10364256-B2 | Biaryl pyrazoles as NRF2 regulators | 20151006 |
US-2018282349-A1 | Biaryl pyrazoles as nrf2 regulators | 20151006 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 182.09184952 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 182.09184952 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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