2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol

C18H16O2 — CID 70208336

IUPAC2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol
SMILESOc1ccccc1C1(O)CC=CC=C1c1ccccc1
InChIInChI=1S/C18H16O2/c19-17-12-5-4-11-16(17)18(20)13-7-6-10-15(18)14-8-2-1-3-9-14/h1-12,19-20H,13H2
InChIKeyMUEDBVLEFQNCHW-UHFFFAOYSA-N
MW264.32 g/mol
LogP3.62
Rot. Bonds2

About 2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol

2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol (PubChem CID 70208336) has the molecular formula C18H16O2 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol.

Molecular Properties

Compound Name2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol
PubChem CID70208336
Molecular FormulaC18H16O2
Molecular Weight264.32 g/mol
Exact Mass264.12
IUPAC Name2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol
SMILESOc1ccccc1C1(O)CC=CC=C1c1ccccc1
InChIInChI=1S/C18H16O2/c19-17-12-5-4-11-16(17)18(20)13-7-6-10-15(18)14-8-2-1-3-9-14/h1-12,19-20H,13H2
InChIKeyMUEDBVLEFQNCHW-UHFFFAOYSA-N
XLogP3.62
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol?
The IUPAC name of 2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol (CID 70208336) is 2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol.
What is the SMILES notation for 2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol?
The canonical SMILES for 2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol is Oc1ccccc1C1(O)CC=CC=C1c1ccccc1.
What is the InChIKey of 2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol?
The InChIKey is MUEDBVLEFQNCHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16O2/c19-17-12-5-4-11-16(17)18(20)13-7-6-10-15(18)14-8-2-1-3-9-14/h1-12,19-20H,13H2.
What are the key properties of 2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol?
2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol has a molecular weight of 264.32 g/mol, XLogP of 3.62, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxy-2-phenylcyclohexa-2,4-dien-1-yl)phenol is sourced from PubChem (CID 70208336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).