1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane

C10H14F2 — CID 91453124

IUPAC1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane
SMILESCC1CC1C(=C1CC1)C(C)(F)F
InChIInChI=1S/C10H14F2/c1-6-5-8(6)9(7-3-4-7)10(2,11)12/h6,8H,3-5H2,1-2H3
InChIKeyLYQLJJGOXVLPOG-UHFFFAOYSA-N
MW172.22 g/mol
LogP3.39
Rot. Bonds2

About 1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane

1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane (PubChem CID 91453124) has the molecular formula C10H14F2 and a molecular weight of 172.22 g/mol. Its IUPAC name is 1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane.

Molecular Properties

Compound Name1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane
PubChem CID91453124
Molecular FormulaC10H14F2
Molecular Weight172.22 g/mol
Exact Mass172.11
IUPAC Name1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane
SMILESCC1CC1C(=C1CC1)C(C)(F)F
InChIInChI=1S/C10H14F2/c1-6-5-8(6)9(7-3-4-7)10(2,11)12/h6,8H,3-5H2,1-2H3
InChIKeyLYQLJJGOXVLPOG-UHFFFAOYSA-N
XLogP3.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.22
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane?
The IUPAC name of 1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane (CID 91453124) is 1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane.
What is the SMILES notation for 1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane?
The canonical SMILES for 1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane is CC1CC1C(=C1CC1)C(C)(F)F.
What is the InChIKey of 1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane?
The InChIKey is LYQLJJGOXVLPOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F2/c1-6-5-8(6)9(7-3-4-7)10(2,11)12/h6,8H,3-5H2,1-2H3.
What are the key properties of 1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane?
1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane has a molecular weight of 172.22 g/mol, XLogP of 3.39, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylidene-2,2-difluoropropyl)-2-methylcyclopropane is sourced from PubChem (CID 91453124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).