propane-1,2-diol;1,1,2,2-tetrafluoroethene

C5H8F4O2 — CID 174777178

IUPACpropane-1,2-diol;1,1,2,2-tetrafluoroethene
SMILESCC(O)CO.FC(F)=C(F)F
InChIInChI=1S/C3H8O2.C2F4/c1-3(5)2-4;3-1(4)2(5)6/h3-5H,2H2,1H3;
InChIKeyZIYIMGADVFLEJH-UHFFFAOYSA-N
MW176.11 g/mol
LogP1.35
Rot. Bonds1

About propane-1,2-diol;1,1,2,2-tetrafluoroethene

propane-1,2-diol;1,1,2,2-tetrafluoroethene (PubChem CID 174777178) has the molecular formula C5H8F4O2 and a molecular weight of 176.11 g/mol. Its IUPAC name is propane-1,2-diol;1,1,2,2-tetrafluoroethene.

Molecular Properties

Compound Namepropane-1,2-diol;1,1,2,2-tetrafluoroethene
PubChem CID174777178
Molecular FormulaC5H8F4O2
Molecular Weight176.11 g/mol
Exact Mass176.05
IUPAC Namepropane-1,2-diol;1,1,2,2-tetrafluoroethene
SMILESCC(O)CO.FC(F)=C(F)F
InChIInChI=1S/C3H8O2.C2F4/c1-3(5)2-4;3-1(4)2(5)6/h3-5H,2H2,1H3;
InChIKeyZIYIMGADVFLEJH-UHFFFAOYSA-N
XLogP1.35
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.11
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

propane-1,2-diol
CID 23506506
CID 160650971
CID 160650971
propane-1,2-diol;silver
CID 158521790
propane-1,2-diol;trihydrochloride;dihydrofluoride
CID 174772875
methanol;propane-1,2-diol;hydrochloride
CID 88632623
CID 158929584
CID 158929584
chloroform;propane-1,2-diol
CID 159626759
methoxymethane;propane-1,2-diol
CID 23435252
ethane-1,2-diol;methane;propane-1,2-diol
CID 157128213
nitroxyl;propane-1,2-diol
CID 175455323
CID 87205903
CID 87205903
carbonic acid;(2S)-propane-1,2-diol
CID 70700046

Frequently Asked Questions

What is the IUPAC name of propane-1,2-diol;1,1,2,2-tetrafluoroethene?
The IUPAC name of propane-1,2-diol;1,1,2,2-tetrafluoroethene (CID 174777178) is propane-1,2-diol;1,1,2,2-tetrafluoroethene.
What is the SMILES notation for propane-1,2-diol;1,1,2,2-tetrafluoroethene?
The canonical SMILES for propane-1,2-diol;1,1,2,2-tetrafluoroethene is CC(O)CO.FC(F)=C(F)F.
What is the InChIKey of propane-1,2-diol;1,1,2,2-tetrafluoroethene?
The InChIKey is ZIYIMGADVFLEJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O2.C2F4/c1-3(5)2-4;3-1(4)2(5)6/h3-5H,2H2,1H3;.
What are the key properties of propane-1,2-diol;1,1,2,2-tetrafluoroethene?
propane-1,2-diol;1,1,2,2-tetrafluoroethene has a molecular weight of 176.11 g/mol, XLogP of 1.35, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for propane-1,2-diol;1,1,2,2-tetrafluoroethene is sourced from PubChem (CID 174777178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).