1-methylidene-2-(trifluoromethyl)cyclopentane

C7H9F3 — CID 18520883

IUPAC1-methylidene-2-(trifluoromethyl)cyclopentane
SMILESC=C1CCCC1C(F)(F)F
InChIInChI=1S/C7H9F3/c1-5-3-2-4-6(5)7(8,9)10/h6H,1-4H2
InChIKeyIOBQZCAJJKAYNQ-UHFFFAOYSA-N
MW150.14 g/mol
LogP2.90
Rot. Bonds

About 1-methylidene-2-(trifluoromethyl)cyclopentane

1-methylidene-2-(trifluoromethyl)cyclopentane (PubChem CID 18520883) has the molecular formula C7H9F3 and a molecular weight of 150.14 g/mol. Its IUPAC name is 1-methylidene-2-(trifluoromethyl)cyclopentane.

Molecular Properties

Compound Name1-methylidene-2-(trifluoromethyl)cyclopentane
PubChem CID18520883
Molecular FormulaC7H9F3
Molecular Weight150.14 g/mol
Exact Mass150.07
IUPAC Name1-methylidene-2-(trifluoromethyl)cyclopentane
SMILESC=C1CCCC1C(F)(F)F
InChIInChI=1S/C7H9F3/c1-5-3-2-4-6(5)7(8,9)10/h6H,1-4H2
InChIKeyIOBQZCAJJKAYNQ-UHFFFAOYSA-N
XLogP2.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.14
LogP ≤ 52.90
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-methylidene-2-(trifluoromethyl)cyclopentane?
The IUPAC name of 1-methylidene-2-(trifluoromethyl)cyclopentane (CID 18520883) is 1-methylidene-2-(trifluoromethyl)cyclopentane.
What is the SMILES notation for 1-methylidene-2-(trifluoromethyl)cyclopentane?
The canonical SMILES for 1-methylidene-2-(trifluoromethyl)cyclopentane is C=C1CCCC1C(F)(F)F.
What is the InChIKey of 1-methylidene-2-(trifluoromethyl)cyclopentane?
The InChIKey is IOBQZCAJJKAYNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F3/c1-5-3-2-4-6(5)7(8,9)10/h6H,1-4H2.
What are the key properties of 1-methylidene-2-(trifluoromethyl)cyclopentane?
1-methylidene-2-(trifluoromethyl)cyclopentane has a molecular weight of 150.14 g/mol, XLogP of 2.90, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylidene-2-(trifluoromethyl)cyclopentane is sourced from PubChem (CID 18520883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).