2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol

C19H24O4 — CID 132548292

IUPAC2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol
SMILESCOc1cc(-c2cc(C)cc(C(C)(C)C)c2O)cc(OC)c1O
InChIInChI=1S/C19H24O4/c1-11-7-13(17(20)14(8-11)19(2,3)4)12-9-15(22-5)18(21)16(10-12)23-6/h7-10,20-21H,1-6H3
InChIKeyXLRDGFDXQDLKOO-UHFFFAOYSA-N
MW316.40 g/mol
LogP4.39
Rot. Bonds3

About 2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol

2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol (PubChem CID 132548292) has the molecular formula C19H24O4 and a molecular weight of 316.40 g/mol. Its IUPAC name is 2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol.

Molecular Properties

Compound Name2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol
PubChem CID132548292
Molecular FormulaC19H24O4
Molecular Weight316.40 g/mol
Exact Mass316.17
IUPAC Name2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol
SMILESCOc1cc(-c2cc(C)cc(C(C)(C)C)c2O)cc(OC)c1O
InChIInChI=1S/C19H24O4/c1-11-7-13(17(20)14(8-11)19(2,3)4)12-9-15(22-5)18(21)16(10-12)23-6/h7-10,20-21H,1-6H3
InChIKeyXLRDGFDXQDLKOO-UHFFFAOYSA-N
XLogP4.39
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-tert-butyl-4-methyl-6-phenylphenol
CID 14315744
2-tert-butyl-6-[2-(ethylamino)-4,5-dimethoxyphenyl]-4-methylphenol
CID 151665539
tris(2,6-ditert-butyl-4-methylphenol);samarium
CID 11193670
2,6-ditert-butyl-4-methylphenol;methanol
CID 161478470
Phenol, 2,6-bis(1,1-dimethylethyl)-4-methyl-, sodium salt
CID 87970249
2-tert-butyl-6-methoxybenzene-1,4-diol
CID 121217885
2-tert-butyl-6-[3-(3-tert-butyl-2-hydroxy-5-methylphenyl)-4-phosphanylphenyl]-4-methylphenol
CID 139847731
2,6-ditert-butyl-4-methylphenol;zirconium;hydrochloride
CID 87931050
2,6-ditert-butyl-4-methylphenol;titanium(2+);dichloride
CID 87485865
2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)-(4-methoxyphenyl)phosphanyl]-4-methylphenol
CID 19351828
2-tert-butyl-4,6-dimethylphenol
CID 87814182
2-tert-butyl-4-(3-tert-butyl-4-hydroxy-5-methoxyphenyl)sulfanyl-6-methoxyphenol
CID 19389438

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol?
The IUPAC name of 2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol (CID 132548292) is 2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol.
What is the SMILES notation for 2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol?
The canonical SMILES for 2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol is COc1cc(-c2cc(C)cc(C(C)(C)C)c2O)cc(OC)c1O.
What is the InChIKey of 2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol?
The InChIKey is XLRDGFDXQDLKOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O4/c1-11-7-13(17(20)14(8-11)19(2,3)4)12-9-15(22-5)18(21)16(10-12)23-6/h7-10,20-21H,1-6H3.
What are the key properties of 2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol?
2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol has a molecular weight of 316.40 g/mol, XLogP of 4.39, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-(4-hydroxy-3,5-dimethoxyphenyl)-4-methylphenol is sourced from PubChem (CID 132548292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).