Phloroglucinol

C₆H₆O₃ — CID 359

About Phloroglucinol

Phloroglucinol (PubChem CID 359) has the molecular formula C₆H₆O₃ and a molecular weight of 126.11 g/mol. Its IUPAC name is benzene-1,3,5-triol.

Molecular Properties

• Compound Name: Phloroglucinol
• PubChem CID: 359
• Molecular Formula: C₆H₆O₃
• Molecular Weight: 126.11 g/mol
• Exact Mass: 126.03
• IUPAC Name: benzene-1,3,5-triol
• SMILES: Oc1cc(O)cc(O)c1
• InChI: InChI=1S/C6H6O3/c7-4-1-5(8)3-6(9)2-4/h1-3,7-9H
• InChIKey: QCDYQQDYXPDABM-UHFFFAOYSA-N
• XLogP: 0.80
• TPSA: 60.69 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 3
• Heavy Atoms: 9
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	126.11
LogP ≤ 5	0.80
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of Phloroglucinol?

The IUPAC name of Phloroglucinol (CID 359) is benzene-1,3,5-triol.

What is the SMILES notation for Phloroglucinol?

The canonical SMILES for Phloroglucinol is Oc1cc(O)cc(O)c1.

What is the InChIKey of Phloroglucinol?

The InChIKey is QCDYQQDYXPDABM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6O3/c7-4-1-5(8)3-6(9)2-4/h1-3,7-9H.

What are the key properties of Phloroglucinol?

Phloroglucinol has a molecular weight of 126.11 g/mol, XLogP of 0.80, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for Phloroglucinol is sourced from PubChem (CID 359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 359 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 2153 — approved-drug record (CC BY-SA 4.0)

How this page is built: methodology · editorial policy & corrections.