1-(difluoromethyl)-1-fluoro-2-methylcyclopropane

C5H7F3 — CID 12584496

IUPAC1-(difluoromethyl)-1-fluoro-2-methylcyclopropane
SMILESCC1CC1(F)C(F)F
InChIInChI=1S/C5H7F3/c1-3-2-5(3,8)4(6)7/h3-4H,2H2,1H3
InChIKeyLKKQMMJQAORENF-UHFFFAOYSA-N
MW124.10 g/mol
LogP2.00
Rot. Bonds1

About 1-(difluoromethyl)-1-fluoro-2-methylcyclopropane

1-(difluoromethyl)-1-fluoro-2-methylcyclopropane (PubChem CID 12584496) has the molecular formula C5H7F3 and a molecular weight of 124.10 g/mol. Its IUPAC name is 1-(difluoromethyl)-1-fluoro-2-methylcyclopropane.

Molecular Properties

Compound Name1-(difluoromethyl)-1-fluoro-2-methylcyclopropane
PubChem CID12584496
Molecular FormulaC5H7F3
Molecular Weight124.10 g/mol
Exact Mass124.05
IUPAC Name1-(difluoromethyl)-1-fluoro-2-methylcyclopropane
SMILESCC1CC1(F)C(F)F
InChIInChI=1S/C5H7F3/c1-3-2-5(3,8)4(6)7/h3-4H,2H2,1H3
InChIKeyLKKQMMJQAORENF-UHFFFAOYSA-N
XLogP2.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.10
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(difluoromethyl)-1-fluoro-2-methylcyclopropane?
The IUPAC name of 1-(difluoromethyl)-1-fluoro-2-methylcyclopropane (CID 12584496) is 1-(difluoromethyl)-1-fluoro-2-methylcyclopropane.
What is the SMILES notation for 1-(difluoromethyl)-1-fluoro-2-methylcyclopropane?
The canonical SMILES for 1-(difluoromethyl)-1-fluoro-2-methylcyclopropane is CC1CC1(F)C(F)F.
What is the InChIKey of 1-(difluoromethyl)-1-fluoro-2-methylcyclopropane?
The InChIKey is LKKQMMJQAORENF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7F3/c1-3-2-5(3,8)4(6)7/h3-4H,2H2,1H3.
What are the key properties of 1-(difluoromethyl)-1-fluoro-2-methylcyclopropane?
1-(difluoromethyl)-1-fluoro-2-methylcyclopropane has a molecular weight of 124.10 g/mol, XLogP of 2.00, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(difluoromethyl)-1-fluoro-2-methylcyclopropane is sourced from PubChem (CID 12584496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).