2-phenyl-3-propan-2-ylphenol

C15H16O — CID 54177325

IUPAC2-phenyl-3-propan-2-ylphenol
SMILESCC(C)c1cccc(O)c1-c1ccccc1
InChIInChI=1S/C15H16O/c1-11(2)13-9-6-10-14(16)15(13)12-7-4-3-5-8-12/h3-11,16H,1-2H3
InChIKeyOZHVEGHEGKHFQO-UHFFFAOYSA-N
MW212.29 g/mol
LogP4.18
Rot. Bonds2

About 2-phenyl-3-propan-2-ylphenol

2-phenyl-3-propan-2-ylphenol (PubChem CID 54177325) has the molecular formula C15H16O and a molecular weight of 212.29 g/mol. Its IUPAC name is 2-phenyl-3-propan-2-ylphenol.

Molecular Properties

Compound Name2-phenyl-3-propan-2-ylphenol
PubChem CID54177325
Molecular FormulaC15H16O
Molecular Weight212.29 g/mol
Exact Mass212.12
IUPAC Name2-phenyl-3-propan-2-ylphenol
SMILESCC(C)c1cccc(O)c1-c1ccccc1
InChIInChI=1S/C15H16O/c1-11(2)13-9-6-10-14(16)15(13)12-7-4-3-5-8-12/h3-11,16H,1-2H3
InChIKeyOZHVEGHEGKHFQO-UHFFFAOYSA-N
XLogP4.18
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3-propan-2-ylphenol?
The IUPAC name of 2-phenyl-3-propan-2-ylphenol (CID 54177325) is 2-phenyl-3-propan-2-ylphenol.
What is the SMILES notation for 2-phenyl-3-propan-2-ylphenol?
The canonical SMILES for 2-phenyl-3-propan-2-ylphenol is CC(C)c1cccc(O)c1-c1ccccc1.
What is the InChIKey of 2-phenyl-3-propan-2-ylphenol?
The InChIKey is OZHVEGHEGKHFQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O/c1-11(2)13-9-6-10-14(16)15(13)12-7-4-3-5-8-12/h3-11,16H,1-2H3.
What are the key properties of 2-phenyl-3-propan-2-ylphenol?
2-phenyl-3-propan-2-ylphenol has a molecular weight of 212.29 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3-propan-2-ylphenol is sourced from PubChem (CID 54177325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).