1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene

C6H8F2O2 — CID 173006427

IUPAC1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene
SMILESFC=CCOOCC=CF
InChIInChI=1S/C6H8F2O2/c7-3-1-5-9-10-6-2-4-8/h1-4H,5-6H2
InChIKeyRXGUDSZXFJAZQN-UHFFFAOYSA-N
MW150.12 g/mol
LogP1.90
Rot. Bonds5

About 1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene

1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene (PubChem CID 173006427) has the molecular formula C6H8F2O2 and a molecular weight of 150.12 g/mol. Its IUPAC name is 1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene.

Molecular Properties

Compound Name1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene
PubChem CID173006427
Molecular FormulaC6H8F2O2
Molecular Weight150.12 g/mol
Exact Mass150.05
IUPAC Name1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene
SMILESFC=CCOOCC=CF
InChIInChI=1S/C6H8F2O2/c7-3-1-5-9-10-6-2-4-8/h1-4H,5-6H2
InChIKeyRXGUDSZXFJAZQN-UHFFFAOYSA-N
XLogP1.90
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.12
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene?
The IUPAC name of 1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene (CID 173006427) is 1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene.
What is the SMILES notation for 1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene?
The canonical SMILES for 1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene is FC=CCOOCC=CF.
What is the InChIKey of 1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene?
The InChIKey is RXGUDSZXFJAZQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F2O2/c7-3-1-5-9-10-6-2-4-8/h1-4H,5-6H2.
What are the key properties of 1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene?
1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene has a molecular weight of 150.12 g/mol, XLogP of 1.90, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-3-(3-fluoroprop-2-enylperoxy)prop-1-ene is sourced from PubChem (CID 173006427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).