2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol

C18H22O2 — CID 22011679

IUPAC2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol
SMILESCCc1cc(C)cc(Cc2cc(C)c(O)c(C)c2)c1O
InChIInChI=1S/C18H22O2/c1-5-15-6-11(2)7-16(18(15)20)10-14-8-12(3)17(19)13(4)9-14/h6-9,19-20H,5,10H2,1-4H3
InChIKeyPWZIQXXGMYLRCR-UHFFFAOYSA-N
MW270.37 g/mol
LogP4.18
Rot. Bonds3

About 2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol

2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol (PubChem CID 22011679) has the molecular formula C18H22O2 and a molecular weight of 270.37 g/mol. Its IUPAC name is 2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol.

Molecular Properties

Compound Name2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol
PubChem CID22011679
Molecular FormulaC18H22O2
Molecular Weight270.37 g/mol
Exact Mass270.16
IUPAC Name2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol
SMILESCCc1cc(C)cc(Cc2cc(C)c(O)c(C)c2)c1O
InChIInChI=1S/C18H22O2/c1-5-15-6-11(2)7-16(18(15)20)10-14-8-12(3)17(19)13(4)9-14/h6-9,19-20H,5,10H2,1-4H3
InChIKeyPWZIQXXGMYLRCR-UHFFFAOYSA-N
XLogP4.18
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-bis[(3-ethyl-4-hydroxy-5-methylphenyl)methyl]-4-methylphenol
CID 134464799
2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol
CID 21344476
2-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol
CID 21282731
2-(1,2-13C2)ethyl-4,6-dimethylphenol
CID 102175536
carbanide;2-[[5-[[5-[[5-[[3-[(5-ethyl-2-hydroxy-3-methylphenyl)methyl]-4-hydroxy-5-methylphenyl]methyl]-2-hydroxy-3-methylphenyl]methyl]-2-hydroxy-3-methylphenyl]methyl]-2-hydroxy-3-methylphenyl]methyl]-4,6-dimethylphenol;bis(titanium(2+))
CID 59071786
2-benzyl-6-[(3-benzyl-4-hydroxy-5-methylphenyl)methyl]-4-methylphenol
CID 20743757
4,6-bis[(4-hydroxy-3,5-dimethylphenyl)methyl]-2-methylbenzene-1,3-diol
CID 22925753
4-[(3,5-diethyl-4-hydroxyphenyl)methyl]-2,6-diethylphenol
CID 22999667
2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol
CID 20750468
2-ethyl-4-methyl-6-propylphenol
CID 66879780
2-[(3-ethyl-2-hydroxy-5-octylphenyl)methyl]-6-methyl-4-pentylphenol
CID 20741015
4-ethyl-2,6-dimethylphenol;methane
CID 159618487

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol?
The IUPAC name of 2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol (CID 22011679) is 2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol.
What is the SMILES notation for 2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol?
The canonical SMILES for 2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol is CCc1cc(C)cc(Cc2cc(C)c(O)c(C)c2)c1O.
What is the InChIKey of 2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol?
The InChIKey is PWZIQXXGMYLRCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O2/c1-5-15-6-11(2)7-16(18(15)20)10-14-8-12(3)17(19)13(4)9-14/h6-9,19-20H,5,10H2,1-4H3.
What are the key properties of 2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol?
2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol has a molecular weight of 270.37 g/mol, XLogP of 4.18, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol is sourced from PubChem (CID 22011679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).