1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene

C11H11F3O — CID 175584794

IUPAC1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene
SMILESFC(F)[C@H](F)c1ccccc1OC1CC1
InChIInChI=1S/C11H11F3O/c12-10(11(13)14)8-3-1-2-4-9(8)15-7-5-6-7/h1-4,7,10-11H,5-6H2/t10-/m1/s1
InChIKeyHZGYAALYKCOHDU-SNVBAGLBSA-N
MW216.20 g/mol
LogP3.50
Rot. Bonds4

About 1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene

1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene (PubChem CID 175584794) has the molecular formula C11H11F3O and a molecular weight of 216.20 g/mol. Its IUPAC name is 1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene.

Molecular Properties

Compound Name1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene
PubChem CID175584794
Molecular FormulaC11H11F3O
Molecular Weight216.20 g/mol
Exact Mass216.08
IUPAC Name1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene
SMILESFC(F)[C@H](F)c1ccccc1OC1CC1
InChIInChI=1S/C11H11F3O/c12-10(11(13)14)8-3-1-2-4-9(8)15-7-5-6-7/h1-4,7,10-11H,5-6H2/t10-/m1/s1
InChIKeyHZGYAALYKCOHDU-SNVBAGLBSA-N
XLogP3.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.20
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene?
The IUPAC name of 1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene (CID 175584794) is 1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene.
What is the SMILES notation for 1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene?
The canonical SMILES for 1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene is FC(F)[C@H](F)c1ccccc1OC1CC1.
What is the InChIKey of 1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene?
The InChIKey is HZGYAALYKCOHDU-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H11F3O/c12-10(11(13)14)8-3-1-2-4-9(8)15-7-5-6-7/h1-4,7,10-11H,5-6H2/t10-/m1/s1.
What are the key properties of 1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene?
1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene has a molecular weight of 216.20 g/mol, XLogP of 3.50, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyloxy-2-[(1R)-1,2,2-trifluoroethyl]benzene is sourced from PubChem (CID 175584794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).