1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene

C5H5F5O2 — CID 23264273

IUPAC1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene
SMILESCOCOC(=C(F)F)C(F)(F)F
InChIInChI=1S/C5H5F5O2/c1-11-2-12-3(4(6)7)5(8,9)10/h2H2,1H3
InChIKeyIGLJUZMXPFBPKY-UHFFFAOYSA-N
MW192.08 g/mol
LogP2.28
Rot. Bonds3

About 1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene

1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene (PubChem CID 23264273) has the molecular formula C5H5F5O2 and a molecular weight of 192.08 g/mol. Its IUPAC name is 1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene.

Molecular Properties

Compound Name1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene
PubChem CID23264273
Molecular FormulaC5H5F5O2
Molecular Weight192.08 g/mol
Exact Mass192.02
IUPAC Name1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene
SMILESCOCOC(=C(F)F)C(F)(F)F
InChIInChI=1S/C5H5F5O2/c1-11-2-12-3(4(6)7)5(8,9)10/h2H2,1H3
InChIKeyIGLJUZMXPFBPKY-UHFFFAOYSA-N
XLogP2.28
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.08
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,1,1,2,3,3-Hexafluoro-2-(methoxymethoxy)propane
CID 18974574
1,1,1,2,3,3,3-Heptafluoro-2-(methoxymethoxy)propane
CID 20605370
1,1,3,3,3-Pentafluoro-2-(1-methoxyethoxymethoxy)prop-1-ene
CID 21918064
1,1,1,2,3,3-Hexafluoro-2-[fluoro(methoxy)methoxy]propane
CID 23225962
2,4-Difluoro-5-(trifluoromethyl)-1,3-dioxole
CID 54397821
2-[Ethoxy(methoxy)methoxy]-1,1,3,3,3-pentafluoroprop-1-ene
CID 87168461
2-[2,2-Difluoro-1-(fluoromethoxy)ethenoxy]-1,1,2-trifluoropropane
CID 89033602
2-[1-(Difluoromethoxy)-2,2-difluoroethenoxy]-1,1,1,2-tetrafluoropropane
CID 118933276
4-Fluoro-5-(trifluoromethyl)-1,3-dioxole
CID 132235744
4-(Trifluoromethoxy)-5-(trifluoromethyl)-1,3-dioxole
CID 172818547
1,1-Difluoro-3,3-dimethoxypropa-1,2-diene
CID 102189622

Frequently Asked Questions

What is the IUPAC name of 1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene?
The IUPAC name of 1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene (CID 23264273) is 1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene.
What is the SMILES notation for 1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene?
The canonical SMILES for 1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene is COCOC(=C(F)F)C(F)(F)F.
What is the InChIKey of 1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene?
The InChIKey is IGLJUZMXPFBPKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F5O2/c1-11-2-12-3(4(6)7)5(8,9)10/h2H2,1H3.
What are the key properties of 1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene?
1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene has a molecular weight of 192.08 g/mol, XLogP of 2.28, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3,3,3-pentafluoro-2-(methoxymethoxy)prop-1-ene is sourced from PubChem (CID 23264273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).