2,3,3,3-tetrafluoropropane-1,2-diol

C3H4F4O2 — CID 118327157

IUPAC2,3,3,3-tetrafluoropropane-1,2-diol
SMILESOCC(O)(F)C(F)(F)F
InChIInChI=1S/C3H4F4O2/c4-2(9,1-8)3(5,6)7/h8-9H,1H2
InChIKeySUHSDXYIQYZENU-UHFFFAOYSA-N
MW148.05 g/mol
LogP0.20
Rot. Bonds1

About 2,3,3,3-tetrafluoropropane-1,2-diol

2,3,3,3-tetrafluoropropane-1,2-diol (PubChem CID 118327157) has the molecular formula C3H4F4O2 and a molecular weight of 148.05 g/mol. Its IUPAC name is 2,3,3,3-tetrafluoropropane-1,2-diol.

Molecular Properties

Compound Name2,3,3,3-tetrafluoropropane-1,2-diol
PubChem CID118327157
Molecular FormulaC3H4F4O2
Molecular Weight148.05 g/mol
Exact Mass148.01
IUPAC Name2,3,3,3-tetrafluoropropane-1,2-diol
SMILESOCC(O)(F)C(F)(F)F
InChIInChI=1S/C3H4F4O2/c4-2(9,1-8)3(5,6)7/h8-9H,1H2
InChIKeySUHSDXYIQYZENU-UHFFFAOYSA-N
XLogP0.20
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.05
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3,3,3-tetrafluoropropane-1,2-diol?
The IUPAC name of 2,3,3,3-tetrafluoropropane-1,2-diol (CID 118327157) is 2,3,3,3-tetrafluoropropane-1,2-diol.
What is the SMILES notation for 2,3,3,3-tetrafluoropropane-1,2-diol?
The canonical SMILES for 2,3,3,3-tetrafluoropropane-1,2-diol is OCC(O)(F)C(F)(F)F.
What is the InChIKey of 2,3,3,3-tetrafluoropropane-1,2-diol?
The InChIKey is SUHSDXYIQYZENU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4F4O2/c4-2(9,1-8)3(5,6)7/h8-9H,1H2.
What are the key properties of 2,3,3,3-tetrafluoropropane-1,2-diol?
2,3,3,3-tetrafluoropropane-1,2-diol has a molecular weight of 148.05 g/mol, XLogP of 0.20, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3,3-tetrafluoropropane-1,2-diol is sourced from PubChem (CID 118327157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).