(1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene

C11H10F4O — CID 67121811

IUPAC(1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene
SMILESCO[C@@H]1CCc2c1cc(F)cc2C(F)(F)F
InChIInChI=1S/C11H10F4O/c1-16-10-3-2-7-8(10)4-6(12)5-9(7)11(13,14)15/h4-5,10H,2-3H2,1H3/t10-/m1/s1
InChIKeyYKESBPQYSAWNJO-SNVBAGLBSA-N
MW234.19 g/mol
LogP3.48
Rot. Bonds1

About (1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene

(1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene (PubChem CID 67121811) has the molecular formula C11H10F4O and a molecular weight of 234.19 g/mol. Its IUPAC name is (1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name(1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene
PubChem CID67121811
Molecular FormulaC11H10F4O
Molecular Weight234.19 g/mol
Exact Mass234.07
IUPAC Name(1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene
SMILESCO[C@@H]1CCc2c1cc(F)cc2C(F)(F)F
InChIInChI=1S/C11H10F4O/c1-16-10-3-2-7-8(10)4-6(12)5-9(7)11(13,14)15/h4-5,10H,2-3H2,1H3/t10-/m1/s1
InChIKeyYKESBPQYSAWNJO-SNVBAGLBSA-N
XLogP3.48
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.19
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene?
The IUPAC name of (1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene (CID 67121811) is (1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene.
What is the SMILES notation for (1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene?
The canonical SMILES for (1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene is CO[C@@H]1CCc2c1cc(F)cc2C(F)(F)F.
What is the InChIKey of (1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene?
The InChIKey is YKESBPQYSAWNJO-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H10F4O/c1-16-10-3-2-7-8(10)4-6(12)5-9(7)11(13,14)15/h4-5,10H,2-3H2,1H3/t10-/m1/s1.
What are the key properties of (1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene?
(1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene has a molecular weight of 234.19 g/mol, XLogP of 3.48, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-6-fluoro-1-methoxy-4-(trifluoromethyl)-2,3-dihydro-1H-indene is sourced from PubChem (CID 67121811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).