1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol

Name: 1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₅H₁₀F₆O — CID 151590259

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol

SMILESOC(c1cccc(-c2ccccc2)c1)(C(F)(F)F)C(F)(F)F

InChIInChI=1S/C15H10F6O/c16-14(17,18)13(22,15(19,20)21)12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9,22H

InChIKeyQIIXJYQOVBRAII-UHFFFAOYSA-N

MW320.23 g/mol

LogP4.67

Rot. Bonds2

About 1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol

1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol (PubChem CID 151590259) has the molecular formula C₁₅H₁₀F₆O and a molecular weight of 320.23 g/mol. Its IUPAC name is 1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol.

Molecular Properties

Compound Name	1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol
PubChem CID	151590259
Molecular Formula	C₁₅H₁₀F₆O
Molecular Weight	320.23 g/mol
Exact Mass	320.06
IUPAC Name	1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol
SMILES	OC(c1cccc(-c2ccccc2)c1)(C(F)(F)F)C(F)(F)F
InChI	InChI=1S/C15H10F6O/c16-14(17,18)13(22,15(19,20)21)12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9,22H
InChIKey	QIIXJYQOVBRAII-UHFFFAOYSA-N
XLogP	4.67
TPSA	20.23 Å²
H-Bond Donors	1
H-Bond Acceptors	1
Rotatable Bonds	2
Heavy Atoms	22
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	320.23
LogP ≤ 5	4.67
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of 1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol?

The IUPAC name of 1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol (CID 151590259) is 1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol.

What is the SMILES notation for 1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol?

The canonical SMILES for 1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol is OC(c1cccc(-c2ccccc2)c1)(C(F)(F)F)C(F)(F)F.

What is the InChIKey of 1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol?

The InChIKey is QIIXJYQOVBRAII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F6O/c16-14(17,18)13(22,15(19,20)21)12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9,22H.

What are the key properties of 1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol?

1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol has a molecular weight of 320.23 g/mol, XLogP of 4.67, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 1,1,1,3,3,3-hexafluoro-2-(3-phenylphenyl)propan-2-ol is sourced from PubChem (CID 151590259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 151590259 — identifiers, structure, computed properties (public domain)

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