1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol

C11H15F3O2 — CID 102650636

IUPAC1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol
SMILESOC1(C2=CCCO2)CCC(C(F)(F)F)CC1
InChIInChI=1S/C11H15F3O2/c12-11(13,14)8-3-5-10(15,6-4-8)9-2-1-7-16-9/h2,8,15H,1,3-7H2
InChIKeyQDDWOYDHCDWYHB-UHFFFAOYSA-N
MW236.23 g/mol
LogP2.77
Rot. Bonds1

About 1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol

1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol (PubChem CID 102650636) has the molecular formula C11H15F3O2 and a molecular weight of 236.23 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol
PubChem CID102650636
Molecular FormulaC11H15F3O2
Molecular Weight236.23 g/mol
Exact Mass236.10
IUPAC Name1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol
SMILESOC1(C2=CCCO2)CCC(C(F)(F)F)CC1
InChIInChI=1S/C11H15F3O2/c12-11(13,14)8-3-5-10(15,6-4-8)9-2-1-7-16-9/h2,8,15H,1,3-7H2
InChIKeyQDDWOYDHCDWYHB-UHFFFAOYSA-N
XLogP2.77
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.23
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol (CID 102650636) is 1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol is OC1(C2=CCCO2)CCC(C(F)(F)F)CC1.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol?
The InChIKey is QDDWOYDHCDWYHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3O2/c12-11(13,14)8-3-5-10(15,6-4-8)9-2-1-7-16-9/h2,8,15H,1,3-7H2.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol?
1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol has a molecular weight of 236.23 g/mol, XLogP of 2.77, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-4-(trifluoromethyl)cyclohexan-1-ol is sourced from PubChem (CID 102650636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).