(2-tert-butyl-6-ethyl-4-methylphenyl)methanol

C14H22O — CID 123284303

IUPAC(2-tert-butyl-6-ethyl-4-methylphenyl)methanol
SMILESCCc1cc(C)cc(C(C)(C)C)c1CO
InChIInChI=1S/C14H22O/c1-6-11-7-10(2)8-13(12(11)9-15)14(3,4)5/h7-8,15H,6,9H2,1-5H3
InChIKeyQSOZTHRDIOPQJO-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.35
Rot. Bonds2

About (2-tert-butyl-6-ethyl-4-methylphenyl)methanol

(2-tert-butyl-6-ethyl-4-methylphenyl)methanol (PubChem CID 123284303) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is (2-tert-butyl-6-ethyl-4-methylphenyl)methanol.

Molecular Properties

Compound Name(2-tert-butyl-6-ethyl-4-methylphenyl)methanol
PubChem CID123284303
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Name(2-tert-butyl-6-ethyl-4-methylphenyl)methanol
SMILESCCc1cc(C)cc(C(C)(C)C)c1CO
InChIInChI=1S/C14H22O/c1-6-11-7-10(2)8-13(12(11)9-15)14(3,4)5/h7-8,15H,6,9H2,1-5H3
InChIKeyQSOZTHRDIOPQJO-UHFFFAOYSA-N
XLogP3.35
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2-tert-butyl-6-ethyl-4-methylphenyl)methanol?
The IUPAC name of (2-tert-butyl-6-ethyl-4-methylphenyl)methanol (CID 123284303) is (2-tert-butyl-6-ethyl-4-methylphenyl)methanol.
What is the SMILES notation for (2-tert-butyl-6-ethyl-4-methylphenyl)methanol?
The canonical SMILES for (2-tert-butyl-6-ethyl-4-methylphenyl)methanol is CCc1cc(C)cc(C(C)(C)C)c1CO.
What is the InChIKey of (2-tert-butyl-6-ethyl-4-methylphenyl)methanol?
The InChIKey is QSOZTHRDIOPQJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O/c1-6-11-7-10(2)8-13(12(11)9-15)14(3,4)5/h7-8,15H,6,9H2,1-5H3.
What are the key properties of (2-tert-butyl-6-ethyl-4-methylphenyl)methanol?
(2-tert-butyl-6-ethyl-4-methylphenyl)methanol has a molecular weight of 206.33 g/mol, XLogP of 3.35, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-tert-butyl-6-ethyl-4-methylphenyl)methanol is sourced from PubChem (CID 123284303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).