8-Hydroxy-8-(trifluoromethyl)-1,4-dioxaspiro[4.5]decane - CAS 1248081-37-9
Catalog: |
BB005996 |
Product Name: |
8-Hydroxy-8-(trifluoromethyl)-1,4-dioxaspiro[4.5]decane |
CAS: |
1248081-37-9 |
Synonyms: |
8-(trifluoromethyl)-1,4-dioxaspiro[4.5]decan-8-ol; 8-(trifluoromethyl)-1,4-dioxaspiro[4.5]decan-8-ol |
IUPAC Name: | 8-(trifluoromethyl)-1,4-dioxaspiro[4.5]decan-8-ol |
Description: | 8-Hydroxy-8-(trifluoromethyl)-1,4-dioxaspiro[4.5]decane (CAS# 1248081-37-9) is a useful research chemical. |
Molecular Weight: | 226.19 |
Molecular Formula: | C9H13F3O3 |
Canonical SMILES: | C1CC2(CCC1(C(F)(F)F)O)OCCO2 |
InChI: | InChI=1S/C9H13F3O3/c10-9(11,12)7(13)1-3-8(4-2-7)14-5-6-15-8/h13H,1-6H2 |
InChI Key: | SQSSOKYNTBRSCM-UHFFFAOYSA-N |
LogP: | 1.59690 |
Publication Number | Title | Priority Date |
WO-2020168143-A1 | Substituted bicyclic compounds as farnesoid x receptor modulators | 20190215 |
US-2021261535-A1 | Substituted bicyclic compounds as farnesoid x receptor modulators | 20190215 |
AU-2016373530-A1 | Compounds useful as kinase inhibitors | 20151216 |
CA-3008488-A1 | Compounds useful as kinase inhibitors | 20151216 |
EA-035132-B1 | COMPOUNDS THAT CAN BE USED AS KINASE INHIBITORS | 20151216 |
Complexity: | 236 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 226.08167876 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 226.08167876 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 38.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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