2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol

C18H22O2 — CID 20750468

IUPAC2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol
SMILESCOc1c(C)cc(Cc2cc(C)cc(C)c2O)cc1C
InChIInChI=1S/C18H22O2/c1-11-6-12(2)17(19)16(7-11)10-15-8-13(3)18(20-5)14(4)9-15/h6-9,19H,10H2,1-5H3
InChIKeyCFCSJPSTPSILET-UHFFFAOYSA-N
MW270.37 g/mol
LogP4.23
Rot. Bonds3

About 2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol

2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol (PubChem CID 20750468) has the molecular formula C18H22O2 and a molecular weight of 270.37 g/mol. Its IUPAC name is 2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol.

Molecular Properties

Compound Name2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol
PubChem CID20750468
Molecular FormulaC18H22O2
Molecular Weight270.37 g/mol
Exact Mass270.16
IUPAC Name2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol
SMILESCOc1c(C)cc(Cc2cc(C)cc(C)c2O)cc1C
InChIInChI=1S/C18H22O2/c1-11-6-12(2)17(19)16(7-11)10-15-8-13(3)18(20-5)14(4)9-15/h6-9,19H,10H2,1-5H3
InChIKeyCFCSJPSTPSILET-UHFFFAOYSA-N
XLogP4.23
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol
CID 21282731
2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol
CID 21344476
2-benzyl-6-[(3-benzyl-4-hydroxy-5-methylphenyl)methyl]-4-methylphenol
CID 20743757
2,6-bis[(3-ethyl-4-hydroxy-5-methylphenyl)methyl]-4-methylphenol
CID 134464799
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-ethyl-6-[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenol
CID 22011679
2-[[2-hydroxy-3-[(2-hydroxy-3,5-dimethylphenyl)methoxymethyl]-5-methylphenyl]methyl]-4,6-dimethylphenol
CID 118528705
ethane;2-methoxy-1,3,5-trimethylbenzene
CID 142174927
2,5-bis[(2-hydroxy-3,5-dimethylphenyl)methyl]benzene-1,4-diol
CID 58625699
2-methoxy-1,3-dimethyl-5-[(4-methylphenyl)methyl]benzene
CID 71397696
4-[[3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methyl-2-(tetrabutyl-λ5-phosphanyl)oxyphenyl]methyl]-2,6-dimethylphenol
CID 153401532
2,6-bis[(4-hydroxy-3,5-dimethylphenyl)methyl]-4-methylphenolate;tetrakis(2-carboxyethyl)azanium
CID 153401515

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol?
The IUPAC name of 2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol (CID 20750468) is 2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol.
What is the SMILES notation for 2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol?
The canonical SMILES for 2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol is COc1c(C)cc(Cc2cc(C)cc(C)c2O)cc1C.
What is the InChIKey of 2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol?
The InChIKey is CFCSJPSTPSILET-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O2/c1-11-6-12(2)17(19)16(7-11)10-15-8-13(3)18(20-5)14(4)9-15/h6-9,19H,10H2,1-5H3.
What are the key properties of 2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol?
2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol has a molecular weight of 270.37 g/mol, XLogP of 4.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol is sourced from PubChem (CID 20750468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).