1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane

C7H11F3 — CID 121273893

IUPAC1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane
SMILESCC1CC1C(C)C(F)(F)F
InChIInChI=1S/C7H11F3/c1-4-3-6(4)5(2)7(8,9)10/h4-6H,3H2,1-2H3
InChIKeyXYJFGIQFIZJFAY-UHFFFAOYSA-N
MW152.16 g/mol
LogP2.84
Rot. Bonds1

About 1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane

1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane (PubChem CID 121273893) has the molecular formula C7H11F3 and a molecular weight of 152.16 g/mol. Its IUPAC name is 1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane.

Molecular Properties

Compound Name1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane
PubChem CID121273893
Molecular FormulaC7H11F3
Molecular Weight152.16 g/mol
Exact Mass152.08
IUPAC Name1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane
SMILESCC1CC1C(C)C(F)(F)F
InChIInChI=1S/C7H11F3/c1-4-3-6(4)5(2)7(8,9)10/h4-6H,3H2,1-2H3
InChIKeyXYJFGIQFIZJFAY-UHFFFAOYSA-N
XLogP2.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.16
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane?
The IUPAC name of 1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane (CID 121273893) is 1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane.
What is the SMILES notation for 1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane?
The canonical SMILES for 1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane is CC1CC1C(C)C(F)(F)F.
What is the InChIKey of 1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane?
The InChIKey is XYJFGIQFIZJFAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3/c1-4-3-6(4)5(2)7(8,9)10/h4-6H,3H2,1-2H3.
What are the key properties of 1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane?
1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane has a molecular weight of 152.16 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(1,1,1-trifluoropropan-2-yl)cyclopropane is sourced from PubChem (CID 121273893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).