1,1,2,2-tetrafluoropropan-1-ol

C3H4F4O — CID 12757724

IUPAC1,1,2,2-tetrafluoropropan-1-ol
SMILESCC(F)(F)C(O)(F)F
InChIInChI=1S/C3H4F4O/c1-2(4,5)3(6,7)8/h8H,1H3
InChIKeyCSUFEOXMCRPQBB-UHFFFAOYSA-N
MW132.06 g/mol
LogP1.23
Rot. Bonds1

About 1,1,2,2-tetrafluoropropan-1-ol

1,1,2,2-tetrafluoropropan-1-ol (PubChem CID 12757724) has the molecular formula C3H4F4O and a molecular weight of 132.06 g/mol. Its IUPAC name is 1,1,2,2-tetrafluoropropan-1-ol.

Molecular Properties

Compound Name1,1,2,2-tetrafluoropropan-1-ol
PubChem CID12757724
Molecular FormulaC3H4F4O
Molecular Weight132.06 g/mol
Exact Mass132.02
IUPAC Name1,1,2,2-tetrafluoropropan-1-ol
SMILESCC(F)(F)C(O)(F)F
InChIInChI=1S/C3H4F4O/c1-2(4,5)3(6,7)8/h8H,1H3
InChIKeyCSUFEOXMCRPQBB-UHFFFAOYSA-N
XLogP1.23
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.06
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetrafluoropropan-1-ol?
The IUPAC name of 1,1,2,2-tetrafluoropropan-1-ol (CID 12757724) is 1,1,2,2-tetrafluoropropan-1-ol.
What is the SMILES notation for 1,1,2,2-tetrafluoropropan-1-ol?
The canonical SMILES for 1,1,2,2-tetrafluoropropan-1-ol is CC(F)(F)C(O)(F)F.
What is the InChIKey of 1,1,2,2-tetrafluoropropan-1-ol?
The InChIKey is CSUFEOXMCRPQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4F4O/c1-2(4,5)3(6,7)8/h8H,1H3.
What are the key properties of 1,1,2,2-tetrafluoropropan-1-ol?
1,1,2,2-tetrafluoropropan-1-ol has a molecular weight of 132.06 g/mol, XLogP of 1.23, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetrafluoropropan-1-ol is sourced from PubChem (CID 12757724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).