2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane

C6H8F2O2 — CID 58612477

IUPAC2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane
SMILESC/C(F)=C(\F)OCC1CO1
InChIInChI=1S/C6H8F2O2/c1-4(7)6(8)10-3-5-2-9-5/h5H,2-3H2,1H3/b6-4-
InChIKeyAWJSKYKIBFNSKM-XQRVVYSFSA-N
MW150.12 g/mol
LogP1.53
Rot. Bonds3

About 2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane

2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane (PubChem CID 58612477) has the molecular formula C6H8F2O2 and a molecular weight of 150.12 g/mol. Its IUPAC name is 2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane.

Molecular Properties

Compound Name2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane
PubChem CID58612477
Molecular FormulaC6H8F2O2
Molecular Weight150.12 g/mol
Exact Mass150.05
IUPAC Name2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane
SMILESC/C(F)=C(\F)OCC1CO1
InChIInChI=1S/C6H8F2O2/c1-4(7)6(8)10-3-5-2-9-5/h5H,2-3H2,1H3/b6-4-
InChIKeyAWJSKYKIBFNSKM-XQRVVYSFSA-N
XLogP1.53
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.12
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[[(E)-1,2,3,3,3-pentafluoroprop-1-enoxy]methyl]oxirane
CID 58612478
2-Pentafluoropropenyloxymethyl-oxirane
CID 76837663
2-[[(Z)-1,2,3,3,3-pentafluoroprop-1-enoxy]methyl]oxirane
CID 87924675
Fluoromethane;2-(fluoromethoxymethyl)oxirane
CID 91076507

Frequently Asked Questions

What is the IUPAC name of 2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane?
The IUPAC name of 2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane (CID 58612477) is 2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane.
What is the SMILES notation for 2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane?
The canonical SMILES for 2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane is C/C(F)=C(\F)OCC1CO1.
What is the InChIKey of 2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane?
The InChIKey is AWJSKYKIBFNSKM-XQRVVYSFSA-N. The full InChI is InChI=1S/C6H8F2O2/c1-4(7)6(8)10-3-5-2-9-5/h5H,2-3H2,1H3/b6-4-.
What are the key properties of 2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane?
2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane has a molecular weight of 150.12 g/mol, XLogP of 1.53, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(E)-1,2-difluoroprop-1-enoxy]methyl]oxirane is sourced from PubChem (CID 58612477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).