2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene)

C19H16F22O4 — CID 91368792

IUPAC2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene)
SMILESC=C(F)C(F)(F)OC(F)(C(F)(F)F)C(F)(F)OC(F)(CO)C(F)(F)F.C=C(OC)C(F)(F)F.C=CC(F)(F)F.C=CC(F)(F)F
InChIInChI=1S/C9H5F13O3.C4H5F3O.2C3H3F3/c1-3(10)5(12,13)25-6(14,8(18,19)20)9(21,22)24-4(11,2-23)7(15,16)17;1-3(8-2)4(5,6)7;2*1-2-3(4,5)6/h23H,1-2H2;1H2,2H3;2*2H,1H2
InChIKeyOHHSGBBVNSXBPQ-UHFFFAOYSA-N
MW726.29 g/mol
LogP9.32
Rot. Bonds8

About 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene)

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene) (PubChem CID 91368792) has the molecular formula C19H16F22O4 and a molecular weight of 726.29 g/mol. Its IUPAC name is 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene).

Molecular Properties

Compound Name2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene)
PubChem CID91368792
Molecular FormulaC19H16F22O4
Molecular Weight726.29 g/mol
Exact Mass726.07
IUPAC Name2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene)
SMILESC=C(F)C(F)(F)OC(F)(C(F)(F)F)C(F)(F)OC(F)(CO)C(F)(F)F.C=C(OC)C(F)(F)F.C=CC(F)(F)F.C=CC(F)(F)F
InChIInChI=1S/C9H5F13O3.C4H5F3O.2C3H3F3/c1-3(10)5(12,13)25-6(14,8(18,19)20)9(21,22)24-4(11,2-23)7(15,16)17;1-3(8-2)4(5,6)7;2*1-2-3(4,5)6/h23H,1-2H2;1H2,2H3;2*2H,1H2
InChIKeyOHHSGBBVNSXBPQ-UHFFFAOYSA-N
XLogP9.32
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500726.29
LogP ≤ 59.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,3,3,3-Tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;1,1,1,2-tetrafluoro-3-methoxy-2-(1,1,2-trifluoroprop-2-enoxy)propane;3,3,3-trifluoroprop-1-ene
CID 54541396
(E)-1,4-bis[1,1,2-trifluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)ethoxy]but-2-ene;(E)-but-2-ene-1,4-diol;1,1,1,2,2,3,3-heptafluoro-3-(1,2,2-trifluoroethenoxy)propane;methane
CID 158491159
Ethene;methane;methoxyethene;prop-1-ene;2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene)
CID 160774766
1,1,1,2,2,3,3-Heptafluoro-3-(1,2,2-trifluoroethenoxy)propane;1,1,1,2,2,3,3-heptafluoro-3-[1,2,2-trifluoro-2-[3-prop-2-enoxy-2-[1,1,2-trifluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)ethoxy]propoxy]ethoxy]propane;methane;3-prop-2-enoxypropane-1,2-diol
CID 161901505
1,1,1,2,2,3,3-Heptafluoro-3-(1,2,2-trifluoroethenoxy)propane;1,1,1,2,2,3,3-heptafluoro-3-[1,2,2-trifluoro-2-[3-prop-2-enoxy-2-[1,1,2-trifluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)ethoxy]propoxy]ethoxy]propane;3-prop-2-enoxypropane-1,2-diol
CID 163923656

Frequently Asked Questions

What is the IUPAC name of 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene)?
The IUPAC name of 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene) (CID 91368792) is 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene).
What is the SMILES notation for 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene)?
The canonical SMILES for 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene) is C=C(F)C(F)(F)OC(F)(C(F)(F)F)C(F)(F)OC(F)(CO)C(F)(F)F.C=C(OC)C(F)(F)F.C=CC(F)(F)F.C=CC(F)(F)F.
What is the InChIKey of 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene)?
The InChIKey is OHHSGBBVNSXBPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5F13O3.C4H5F3O.2C3H3F3/c1-3(10)5(12,13)25-6(14,8(18,19)20)9(21,22)24-4(11,2-23)7(15,16)17;1-3(8-2)4(5,6)7;2*1-2-3(4,5)6/h23H,1-2H2;1H2,2H3;2*2H,1H2.
What are the key properties of 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene)?
2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene) has a molecular weight of 726.29 g/mol, XLogP of 9.32, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)propoxy]propan-1-ol;3,3,3-trifluoro-2-methoxyprop-1-ene;bis(3,3,3-trifluoroprop-1-ene) is sourced from PubChem (CID 91368792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).