2-(1-hydroxy-3-phenylpropyl)phenol

C15H16O2 — CID 12648148

IUPAC2-(1-hydroxy-3-phenylpropyl)phenol
SMILESOc1ccccc1C(O)CCc1ccccc1
InChIInChI=1S/C15H16O2/c16-14-9-5-4-8-13(14)15(17)11-10-12-6-2-1-3-7-12/h1-9,15-17H,10-11H2
InChIKeyQUUBUNVEPTYPHI-UHFFFAOYSA-N
MW228.29 g/mol
LogP3.06
Rot. Bonds4

About 2-(1-hydroxy-3-phenylpropyl)phenol

2-(1-hydroxy-3-phenylpropyl)phenol (PubChem CID 12648148) has the molecular formula C15H16O2 and a molecular weight of 228.29 g/mol. Its IUPAC name is 2-(1-hydroxy-3-phenylpropyl)phenol.

Molecular Properties

Compound Name2-(1-hydroxy-3-phenylpropyl)phenol
PubChem CID12648148
Molecular FormulaC15H16O2
Molecular Weight228.29 g/mol
Exact Mass228.12
IUPAC Name2-(1-hydroxy-3-phenylpropyl)phenol
SMILESOc1ccccc1C(O)CCc1ccccc1
InChIInChI=1S/C15H16O2/c16-14-9-5-4-8-13(14)15(17)11-10-12-6-2-1-3-7-12/h1-9,15-17H,10-11H2
InChIKeyQUUBUNVEPTYPHI-UHFFFAOYSA-N
XLogP3.06
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxy-3-phenylpropyl)phenol?
The IUPAC name of 2-(1-hydroxy-3-phenylpropyl)phenol (CID 12648148) is 2-(1-hydroxy-3-phenylpropyl)phenol.
What is the SMILES notation for 2-(1-hydroxy-3-phenylpropyl)phenol?
The canonical SMILES for 2-(1-hydroxy-3-phenylpropyl)phenol is Oc1ccccc1C(O)CCc1ccccc1.
What is the InChIKey of 2-(1-hydroxy-3-phenylpropyl)phenol?
The InChIKey is QUUBUNVEPTYPHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2/c16-14-9-5-4-8-13(14)15(17)11-10-12-6-2-1-3-7-12/h1-9,15-17H,10-11H2.
What are the key properties of 2-(1-hydroxy-3-phenylpropyl)phenol?
2-(1-hydroxy-3-phenylpropyl)phenol has a molecular weight of 228.29 g/mol, XLogP of 3.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxy-3-phenylpropyl)phenol is sourced from PubChem (CID 12648148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).