2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol

C23H24O2 — CID 67659953

IUPAC2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol
SMILESCCc1c(-c2ccc(O)cc2)cccc1C(C)(C)c1ccccc1O
InChIInChI=1S/C23H24O2/c1-4-18-19(16-12-14-17(24)15-13-16)8-7-10-20(18)23(2,3)21-9-5-6-11-22(21)25/h5-15,24-25H,4H2,1-3H3
InChIKeyQOWCWXWAHVPWEA-UHFFFAOYSA-N
MW332.44 g/mol
LogP5.65
Rot. Bonds4

About 2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol

2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol (PubChem CID 67659953) has the molecular formula C23H24O2 and a molecular weight of 332.44 g/mol. Its IUPAC name is 2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol.

Molecular Properties

Compound Name2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol
PubChem CID67659953
Molecular FormulaC23H24O2
Molecular Weight332.44 g/mol
Exact Mass332.18
IUPAC Name2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol
SMILESCCc1c(-c2ccc(O)cc2)cccc1C(C)(C)c1ccccc1O
InChIInChI=1S/C23H24O2/c1-4-18-19(16-12-14-17(24)15-13-16)8-7-10-20(18)23(2,3)21-9-5-6-11-22(21)25/h5-15,24-25H,4H2,1-3H3
InChIKeyQOWCWXWAHVPWEA-UHFFFAOYSA-N
XLogP5.65
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.44
LogP ≤ 55.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol?
The IUPAC name of 2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol (CID 67659953) is 2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol.
What is the SMILES notation for 2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol?
The canonical SMILES for 2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol is CCc1c(-c2ccc(O)cc2)cccc1C(C)(C)c1ccccc1O.
What is the InChIKey of 2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol?
The InChIKey is QOWCWXWAHVPWEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24O2/c1-4-18-19(16-12-14-17(24)15-13-16)8-7-10-20(18)23(2,3)21-9-5-6-11-22(21)25/h5-15,24-25H,4H2,1-3H3.
What are the key properties of 2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol?
2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol has a molecular weight of 332.44 g/mol, XLogP of 5.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-ethyl-3-(4-hydroxyphenyl)phenyl]propan-2-yl]phenol is sourced from PubChem (CID 67659953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).