1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol

C15H25F3O — CID 64756338

IUPAC1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol
SMILESCCC1CCC(C2(O)CCC(C(F)(F)F)CC2)CC1
InChIInChI=1S/C15H25F3O/c1-2-11-3-5-12(6-4-11)14(19)9-7-13(8-10-14)15(16,17)18/h11-13,19H,2-10H2,1H3
InChIKeyHLNFUPYKNBBPNN-UHFFFAOYSA-N
MW278.36 g/mol
LogP4.69
Rot. Bonds2

About 1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol

1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol (PubChem CID 64756338) has the molecular formula C15H25F3O and a molecular weight of 278.36 g/mol. Its IUPAC name is 1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol
PubChem CID64756338
Molecular FormulaC15H25F3O
Molecular Weight278.36 g/mol
Exact Mass278.19
IUPAC Name1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol
SMILESCCC1CCC(C2(O)CCC(C(F)(F)F)CC2)CC1
InChIInChI=1S/C15H25F3O/c1-2-11-3-5-12(6-4-11)14(19)9-7-13(8-10-14)15(16,17)18/h11-13,19H,2-10H2,1H3
InChIKeyHLNFUPYKNBBPNN-UHFFFAOYSA-N
XLogP4.69
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-Cyclohexyl-1,1,1-trifluoropropan-2-ol
CID 61644687
4-(tert-Butyl)-1-(trifluoromethyl)cyclohexanol
CID 14270574
4-Tert-butyl-1-(fluoromethyl)cyclohexan-1-ol
CID 11321411
2,2'-(1,4-Cyclohexanediyl)bis(1,1,1,3,3,3-hexafluoro-2-propanol)
CID 13876330
4-(1,1,1,3,3,3-Hexafluoro-2-hydroxypropan-2-yl)-1-methylcyclohexan-1-ol
CID 13876334
1-Methyl-4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexan-1-ol
CID 14412982
1,1-Dicyclohexyl-2,2,2-trifluoroethanol
CID 15537559
4-(4-Propylcyclohexyl)-1-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)cyclohexan-1-ol
CID 18650478
2-Methyl-5-(4-methylcyclohexyl)-1-(trifluoromethyl)cyclohexan-1-ol
CID 20578475
1,1,1,3,3,3-Hexafluoro-2-[1,2,2,3,6,6-hexafluoro-3-(fluoromethyl)-4,5-dimethylcyclohexyl]propan-2-ol
CID 20743869
1,1,1,3,3,3-Hexafluoro-2-[1,2,2,6-tetrafluoro-3-(fluoromethyl)-4,5-dimethylcyclohexyl]propan-2-ol
CID 20743870
2-[1,2-Difluoro-5-(fluoromethyl)-3,4-dimethylcyclohexyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 20743915

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol?
The IUPAC name of 1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol (CID 64756338) is 1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol.
What is the SMILES notation for 1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol?
The canonical SMILES for 1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol is CCC1CCC(C2(O)CCC(C(F)(F)F)CC2)CC1.
What is the InChIKey of 1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol?
The InChIKey is HLNFUPYKNBBPNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25F3O/c1-2-11-3-5-12(6-4-11)14(19)9-7-13(8-10-14)15(16,17)18/h11-13,19H,2-10H2,1H3.
What are the key properties of 1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol?
1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol has a molecular weight of 278.36 g/mol, XLogP of 4.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylcyclohexyl)-4-(trifluoromethyl)cyclohexan-1-ol is sourced from PubChem (CID 64756338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).