(4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol

C18H26O2 — CID 115836255

IUPAC(4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
SMILESCC1OC(C)C(C(O)c2ccc(C3CCC3)cc2)C1C
InChIInChI=1S/C18H26O2/c1-11-12(2)20-13(3)17(11)18(19)16-9-7-15(8-10-16)14-5-4-6-14/h7-14,17-19H,4-6H2,1-3H3
InChIKeyVLGSNFBNPLFGSW-UHFFFAOYSA-N
MW274.40 g/mol
LogP4.05
Rot. Bonds3

About (4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol

(4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol (PubChem CID 115836255) has the molecular formula C18H26O2 and a molecular weight of 274.40 g/mol. Its IUPAC name is (4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol.

Molecular Properties

Compound Name(4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
PubChem CID115836255
Molecular FormulaC18H26O2
Molecular Weight274.40 g/mol
Exact Mass274.19
IUPAC Name(4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
SMILESCC1OC(C)C(C(O)c2ccc(C3CCC3)cc2)C1C
InChIInChI=1S/C18H26O2/c1-11-12(2)20-13(3)17(11)18(19)16-9-7-15(8-10-16)14-5-4-6-14/h7-14,17-19H,4-6H2,1-3H3
InChIKeyVLGSNFBNPLFGSW-UHFFFAOYSA-N
XLogP4.05
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.40
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
CID 115839005
[(4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methyl]hydrazine
CID 105338209
(4-ethylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
CID 65160020
(4-cyclohexylphenyl)-(5-methyloxolan-2-yl)methanol
CID 81330285
[(3-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methyl]hydrazine
CID 105342042
(3-bromo-4-methoxyphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
CID 65160656
(4-cyclobutylphenyl)-(4-methylmorpholin-2-yl)methanol
CID 116505822
1-(4-cyclobutylphenyl)-2-phenylethane-1,2-diol
CID 103459446
(4-cyclobutylphenyl)-(1,1-dioxothiolan-3-yl)methanol
CID 116505854
(4-chloro-3-methylphenyl)-(4-cyclobutylphenyl)methanol
CID 115836307
(2,3,4,5,6-pentamethylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol
CID 65160661
1-(4-cyclopentylphenyl)hexan-1-ol
CID 91233072

Frequently Asked Questions

What is the IUPAC name of (4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol?
The IUPAC name of (4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol (CID 115836255) is (4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol.
What is the SMILES notation for (4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol?
The canonical SMILES for (4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol is CC1OC(C)C(C(O)c2ccc(C3CCC3)cc2)C1C.
What is the InChIKey of (4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol?
The InChIKey is VLGSNFBNPLFGSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26O2/c1-11-12(2)20-13(3)17(11)18(19)16-9-7-15(8-10-16)14-5-4-6-14/h7-14,17-19H,4-6H2,1-3H3.
What are the key properties of (4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol?
(4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol has a molecular weight of 274.40 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclobutylphenyl)-(2,4,5-trimethyloxolan-3-yl)methanol is sourced from PubChem (CID 115836255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).