(2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone

C18H20O2 — CID 157171330

IUPAC(2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone
SMILESCCc1cccc(O)c1C(=O)c1c(C)cc(C)cc1C
InChIInChI=1S/C18H20O2/c1-5-14-7-6-8-15(19)17(14)18(20)16-12(3)9-11(2)10-13(16)4/h6-10,19H,5H2,1-4H3
InChIKeyJWVGVBFDSJAHMW-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.11
Rot. Bonds3

About (2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone

(2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone (PubChem CID 157171330) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is (2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone.

Molecular Properties

Compound Name(2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone
PubChem CID157171330
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name(2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone
SMILESCCc1cccc(O)c1C(=O)c1c(C)cc(C)cc1C
InChIInChI=1S/C18H20O2/c1-5-14-7-6-8-15(19)17(14)18(20)16-12(3)9-11(2)10-13(16)4/h6-10,19H,5H2,1-4H3
InChIKeyJWVGVBFDSJAHMW-UHFFFAOYSA-N
XLogP4.11
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone?
The IUPAC name of (2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone (CID 157171330) is (2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone.
What is the SMILES notation for (2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone?
The canonical SMILES for (2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone is CCc1cccc(O)c1C(=O)c1c(C)cc(C)cc1C.
What is the InChIKey of (2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone?
The InChIKey is JWVGVBFDSJAHMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-5-14-7-6-8-15(19)17(14)18(20)16-12(3)9-11(2)10-13(16)4/h6-10,19H,5H2,1-4H3.
What are the key properties of (2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone?
(2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone has a molecular weight of 268.36 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-6-hydroxyphenyl)-(2,4,6-trimethylphenyl)methanone is sourced from PubChem (CID 157171330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).