2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol

C18H22O2 — CID 134165367

IUPAC2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol
SMILESCCc1c(C)cc(-c2cc(C)c(CC)c(O)c2)cc1O
InChIInChI=1S/C18H22O2/c1-5-15-11(3)7-13(9-17(15)19)14-8-12(4)16(6-2)18(20)10-14/h7-10,19-20H,5-6H2,1-4H3
InChIKeyIMKLRNFRTAPACT-UHFFFAOYSA-N
MW270.37 g/mol
LogP4.51
Rot. Bonds3

About 2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol

2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol (PubChem CID 134165367) has the molecular formula C18H22O2 and a molecular weight of 270.37 g/mol. Its IUPAC name is 2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol.

Molecular Properties

Compound Name2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol
PubChem CID134165367
Molecular FormulaC18H22O2
Molecular Weight270.37 g/mol
Exact Mass270.16
IUPAC Name2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol
SMILESCCc1c(C)cc(-c2cc(C)c(CC)c(O)c2)cc1O
InChIInChI=1S/C18H22O2/c1-5-15-11(3)7-13(9-17(15)19)14-8-12(4)16(6-2)18(20)10-14/h7-10,19-20H,5-6H2,1-4H3
InChIKeyIMKLRNFRTAPACT-UHFFFAOYSA-N
XLogP4.51
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 ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol?
The IUPAC name of 2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol (CID 134165367) is 2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol.
What is the SMILES notation for 2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol?
The canonical SMILES for 2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol is CCc1c(C)cc(-c2cc(C)c(CC)c(O)c2)cc1O.
What is the InChIKey of 2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol?
The InChIKey is IMKLRNFRTAPACT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O2/c1-5-15-11(3)7-13(9-17(15)19)14-8-12(4)16(6-2)18(20)10-14/h7-10,19-20H,5-6H2,1-4H3.
What are the key properties of 2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol?
2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol has a molecular weight of 270.37 g/mol, XLogP of 4.51, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol is sourced from PubChem (CID 134165367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).