1,2,3-trifluoro-2,3-dihydro-1H-indene

C9H7F3 — CID 122515484

IUPAC1,2,3-trifluoro-2,3-dihydro-1H-indene
SMILESFC1c2ccccc2C(F)C1F
InChIInChI=1S/C9H7F3/c10-7-5-3-1-2-4-6(5)8(11)9(7)12/h1-4,7-9H
InChIKeyADPZQWBLOJOMJO-UHFFFAOYSA-N
MW172.15 g/mol
LogP3.06
Rot. Bonds

About 1,2,3-trifluoro-2,3-dihydro-1H-indene

1,2,3-trifluoro-2,3-dihydro-1H-indene (PubChem CID 122515484) has the molecular formula C9H7F3 and a molecular weight of 172.15 g/mol. Its IUPAC name is 1,2,3-trifluoro-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name1,2,3-trifluoro-2,3-dihydro-1H-indene
PubChem CID122515484
Molecular FormulaC9H7F3
Molecular Weight172.15 g/mol
Exact Mass172.05
IUPAC Name1,2,3-trifluoro-2,3-dihydro-1H-indene
SMILESFC1c2ccccc2C(F)C1F
InChIInChI=1S/C9H7F3/c10-7-5-3-1-2-4-6(5)8(11)9(7)12/h1-4,7-9H
InChIKeyADPZQWBLOJOMJO-UHFFFAOYSA-N
XLogP3.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.15
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,3-trifluoro-2,3-dihydro-1H-indene?
The IUPAC name of 1,2,3-trifluoro-2,3-dihydro-1H-indene (CID 122515484) is 1,2,3-trifluoro-2,3-dihydro-1H-indene.
What is the SMILES notation for 1,2,3-trifluoro-2,3-dihydro-1H-indene?
The canonical SMILES for 1,2,3-trifluoro-2,3-dihydro-1H-indene is FC1c2ccccc2C(F)C1F.
What is the InChIKey of 1,2,3-trifluoro-2,3-dihydro-1H-indene?
The InChIKey is ADPZQWBLOJOMJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F3/c10-7-5-3-1-2-4-6(5)8(11)9(7)12/h1-4,7-9H.
What are the key properties of 1,2,3-trifluoro-2,3-dihydro-1H-indene?
1,2,3-trifluoro-2,3-dihydro-1H-indene has a molecular weight of 172.15 g/mol, XLogP of 3.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3-trifluoro-2,3-dihydro-1H-indene is sourced from PubChem (CID 122515484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).