2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol

C20H26O — CID 65150147

IUPAC2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol
SMILESCCc1ccccc1C(O)Cc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C20H26O/c1-5-16-8-6-7-9-18(16)19(21)14-15-10-12-17(13-11-15)20(2,3)4/h6-13,19,21H,5,14H2,1-4H3
InChIKeyNIBBIRUVRJGVNE-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.82
Rot. Bonds4

About 2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol

2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol (PubChem CID 65150147) has the molecular formula C20H26O and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol.

Molecular Properties

Compound Name2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol
PubChem CID65150147
Molecular FormulaC20H26O
Molecular Weight282.43 g/mol
Exact Mass282.20
IUPAC Name2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol
SMILESCCc1ccccc1C(O)Cc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C20H26O/c1-5-16-8-6-7-9-18(16)19(21)14-15-10-12-17(13-11-15)20(2,3)4/h6-13,19,21H,5,14H2,1-4H3
InChIKeyNIBBIRUVRJGVNE-UHFFFAOYSA-N
XLogP4.82
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-tert-butylphenyl)-1-(2-methylsulfanylphenyl)ethanol
CID 115786607
2-(4-tert-butylphenyl)-1-(3-ethyl-2-pyridinyl)ethanol
CID 82732445
2-(3,5-dimethylphenyl)-1-(2-ethylphenyl)ethanol
CID 63899918
2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(2-ethylphenyl)ethanol
CID 79820321
1-(3-bromo-2-fluorophenyl)-2-(4-tert-butylphenyl)ethanol
CID 107954002
1-(2-ethylphenyl)-3-methylbutan-1-ol
CID 63901974
2-(2,3-dichlorophenyl)-1-(2-ethylphenyl)ethanol
CID 107307475
2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanone
CID 114967852
2-(4-tert-butylphenyl)-1-(3-ethyl-1-methylpyrazol-4-yl)ethanol
CID 115990490
2-(5-chlorothiophen-2-yl)-1-(2-ethylphenyl)ethanol
CID 65150095
2-(1-benzothiophen-3-yl)-1-(2-ethylphenyl)ethanol
CID 65150146
3-(4-tert-butylphenyl)-1-phenylpropane-1,2-diol
CID 103459420

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol?
The IUPAC name of 2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol (CID 65150147) is 2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol.
What is the SMILES notation for 2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol?
The canonical SMILES for 2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol is CCc1ccccc1C(O)Cc1ccc(C(C)(C)C)cc1.
What is the InChIKey of 2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol?
The InChIKey is NIBBIRUVRJGVNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26O/c1-5-16-8-6-7-9-18(16)19(21)14-15-10-12-17(13-11-15)20(2,3)4/h6-13,19,21H,5,14H2,1-4H3.
What are the key properties of 2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol?
2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol has a molecular weight of 282.43 g/mol, XLogP of 4.82, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenyl)-1-(2-ethylphenyl)ethanol is sourced from PubChem (CID 65150147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).