2,3-diethyl-4-(3-ethylphenyl)phenol

C18H22O — CID 101302434

IUPAC2,3-diethyl-4-(3-ethylphenyl)phenol
SMILESCCc1cccc(-c2ccc(O)c(CC)c2CC)c1
InChIInChI=1S/C18H22O/c1-4-13-8-7-9-14(12-13)17-10-11-18(19)16(6-3)15(17)5-2/h7-12,19H,4-6H2,1-3H3
InChIKeyCWSULNUADURWND-UHFFFAOYSA-N
MW254.37 g/mol
LogP4.75
Rot. Bonds4

About 2,3-diethyl-4-(3-ethylphenyl)phenol

2,3-diethyl-4-(3-ethylphenyl)phenol (PubChem CID 101302434) has the molecular formula C18H22O and a molecular weight of 254.37 g/mol. Its IUPAC name is 2,3-diethyl-4-(3-ethylphenyl)phenol.

Molecular Properties

Compound Name2,3-diethyl-4-(3-ethylphenyl)phenol
PubChem CID101302434
Molecular FormulaC18H22O
Molecular Weight254.37 g/mol
Exact Mass254.17
IUPAC Name2,3-diethyl-4-(3-ethylphenyl)phenol
SMILESCCc1cccc(-c2ccc(O)c(CC)c2CC)c1
InChIInChI=1S/C18H22O/c1-4-13-8-7-9-14(12-13)17-10-11-18(19)16(6-3)15(17)5-2/h7-12,19H,4-6H2,1-3H3
InChIKeyCWSULNUADURWND-UHFFFAOYSA-N
XLogP4.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(3-ethylphenyl)-3-fluorophenol
CID 83130273
4-(2-ethyl-3-hydroxyphenyl)benzene-1,2-diol
CID 101303074
3-ethyl-6-(3-ethylphenyl)benzene-1,2-diol
CID 101302583
4-(3,5-diethylphenyl)-3-ethylbenzene-1,2-diol
CID 101302801
2,4-diethyl-6-(3-ethylphenyl)benzene-1,3,5-triol
CID 101303320
4-ethyl-3-(3-ethylphenyl)benzene-1,2-diol
CID 101302577
1,4-diethyl-2-(3-ethylphenyl)benzene
CID 102240202
4-methyl-2-(3-propylphenyl)phenol
CID 116546527
1-ethyl-3-(3-ethylphenyl)benzene;methanediamine
CID 134305122
2,3-diethyl-1,4-diphenylbenzene
CID 59383229
2-ethyl-3-phenylphenol;formaldehyde
CID 175490561
1-bromo-4-ethyl-2-(3-ethylphenyl)benzene
CID 142855411

Frequently Asked Questions

What is the IUPAC name of 2,3-diethyl-4-(3-ethylphenyl)phenol?
The IUPAC name of 2,3-diethyl-4-(3-ethylphenyl)phenol (CID 101302434) is 2,3-diethyl-4-(3-ethylphenyl)phenol.
What is the SMILES notation for 2,3-diethyl-4-(3-ethylphenyl)phenol?
The canonical SMILES for 2,3-diethyl-4-(3-ethylphenyl)phenol is CCc1cccc(-c2ccc(O)c(CC)c2CC)c1.
What is the InChIKey of 2,3-diethyl-4-(3-ethylphenyl)phenol?
The InChIKey is CWSULNUADURWND-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O/c1-4-13-8-7-9-14(12-13)17-10-11-18(19)16(6-3)15(17)5-2/h7-12,19H,4-6H2,1-3H3.
What are the key properties of 2,3-diethyl-4-(3-ethylphenyl)phenol?
2,3-diethyl-4-(3-ethylphenyl)phenol has a molecular weight of 254.37 g/mol, XLogP of 4.75, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diethyl-4-(3-ethylphenyl)phenol is sourced from PubChem (CID 101302434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).