4-(trifluoromethyl)-2,3-dihydro-1H-indene

C10H9F3 — CID 126626843

IUPAC4-(trifluoromethyl)-2,3-dihydro-1H-indene
SMILESFC(F)(F)c1cccc2c1CCC2
InChIInChI=1S/C10H9F3/c11-10(12,13)9-6-2-4-7-3-1-5-8(7)9/h2,4,6H,1,3,5H2
InChIKeyIPVOCGBDYVWVLE-UHFFFAOYSA-N
MW186.18 g/mol
LogP3.19
Rot. Bonds

About 4-(trifluoromethyl)-2,3-dihydro-1H-indene

4-(trifluoromethyl)-2,3-dihydro-1H-indene (PubChem CID 126626843) has the molecular formula C10H9F3 and a molecular weight of 186.18 g/mol. Its IUPAC name is 4-(trifluoromethyl)-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name4-(trifluoromethyl)-2,3-dihydro-1H-indene
PubChem CID126626843
Molecular FormulaC10H9F3
Molecular Weight186.18 g/mol
Exact Mass186.07
IUPAC Name4-(trifluoromethyl)-2,3-dihydro-1H-indene
SMILESFC(F)(F)c1cccc2c1CCC2
InChIInChI=1S/C10H9F3/c11-10(12,13)9-6-2-4-7-3-1-5-8(7)9/h2,4,6H,1,3,5H2
InChIKeyIPVOCGBDYVWVLE-UHFFFAOYSA-N
XLogP3.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.18
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 4-(trifluoromethyl)-2,3-dihydro-1H-indene?
The IUPAC name of 4-(trifluoromethyl)-2,3-dihydro-1H-indene (CID 126626843) is 4-(trifluoromethyl)-2,3-dihydro-1H-indene.
What is the SMILES notation for 4-(trifluoromethyl)-2,3-dihydro-1H-indene?
The canonical SMILES for 4-(trifluoromethyl)-2,3-dihydro-1H-indene is FC(F)(F)c1cccc2c1CCC2.
What is the InChIKey of 4-(trifluoromethyl)-2,3-dihydro-1H-indene?
The InChIKey is IPVOCGBDYVWVLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3/c11-10(12,13)9-6-2-4-7-3-1-5-8(7)9/h2,4,6H,1,3,5H2.
What are the key properties of 4-(trifluoromethyl)-2,3-dihydro-1H-indene?
4-(trifluoromethyl)-2,3-dihydro-1H-indene has a molecular weight of 186.18 g/mol, XLogP of 3.19, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(trifluoromethyl)-2,3-dihydro-1H-indene is sourced from PubChem (CID 126626843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).