2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol

C19H24O2 — CID 71213924

IUPAC2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol
SMILESCc1cc(C)c(O)c(Cc2cc(C)cc(C(C)C)c2O)c1
InChIInChI=1S/C19H24O2/c1-11(2)17-9-13(4)8-16(19(17)21)10-15-7-12(3)6-14(5)18(15)20/h6-9,11,20-21H,10H2,1-5H3
InChIKeyWKQMUBUMOBSNRO-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.74
Rot. Bonds3

About 2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol

2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol (PubChem CID 71213924) has the molecular formula C19H24O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol.

Molecular Properties

Compound Name2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol
PubChem CID71213924
Molecular FormulaC19H24O2
Molecular Weight284.40 g/mol
Exact Mass284.18
IUPAC Name2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol
SMILESCc1cc(C)c(O)c(Cc2cc(C)cc(C(C)C)c2O)c1
InChIInChI=1S/C19H24O2/c1-11(2)17-9-13(4)8-16(19(17)21)10-15-7-12(3)6-14(5)18(15)20/h6-9,11,20-21H,10H2,1-5H3
InChIKeyWKQMUBUMOBSNRO-UHFFFAOYSA-N
XLogP4.74
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Diethylstilbestrol
CID 448537
Bisphenol A
CID 6623
2,4-Dimethylphenol
CID 7771
2,6-Di-tert-butyl-4-methylphenol
CID 31404
Dienestrol
CID 667476
(1,1'-Biphenyl)-2-ol
CID 7017
Magnolol
CID 72300
Hexestrol
CID 192197
2,4-Di-tert-butylphenol
CID 7311
Propofol
CID 4943
4,4'-Dihydroxybiphenyl
CID 7112
Bisphenol B
CID 66166

Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol?
The IUPAC name of 2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol (CID 71213924) is 2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol.
What is the SMILES notation for 2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol?
The canonical SMILES for 2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol is Cc1cc(C)c(O)c(Cc2cc(C)cc(C(C)C)c2O)c1.
What is the InChIKey of 2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol?
The InChIKey is WKQMUBUMOBSNRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O2/c1-11(2)17-9-13(4)8-16(19(17)21)10-15-7-12(3)6-14(5)18(15)20/h6-9,11,20-21H,10H2,1-5H3.
What are the key properties of 2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol?
2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol has a molecular weight of 284.40 g/mol, XLogP of 4.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)methyl]-4,6-dimethylphenol is sourced from PubChem (CID 71213924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).