2,3,4,5-tetrafluoro-1-methyl-1H-indene

C10H6F4 — CID 126756473

IUPAC2,3,4,5-tetrafluoro-1-methyl-1H-indene
SMILESCC1C(F)=C(F)c2c1ccc(F)c2F
InChIInChI=1S/C10H6F4/c1-4-5-2-3-6(11)9(13)7(5)10(14)8(4)12/h2-4H,1H3
InChIKeyKKQDFLSKFRSGGS-UHFFFAOYSA-N
MW202.15 g/mol
LogP3.69
Rot. Bonds

About 2,3,4,5-tetrafluoro-1-methyl-1H-indene

2,3,4,5-tetrafluoro-1-methyl-1H-indene (PubChem CID 126756473) has the molecular formula C10H6F4 and a molecular weight of 202.15 g/mol. Its IUPAC name is 2,3,4,5-tetrafluoro-1-methyl-1H-indene.

Molecular Properties

Compound Name2,3,4,5-tetrafluoro-1-methyl-1H-indene
PubChem CID126756473
Molecular FormulaC10H6F4
Molecular Weight202.15 g/mol
Exact Mass202.04
IUPAC Name2,3,4,5-tetrafluoro-1-methyl-1H-indene
SMILESCC1C(F)=C(F)c2c1ccc(F)c2F
InChIInChI=1S/C10H6F4/c1-4-5-2-3-6(11)9(13)7(5)10(14)8(4)12/h2-4H,1H3
InChIKeyKKQDFLSKFRSGGS-UHFFFAOYSA-N
XLogP3.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.15
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,5-tetrafluoro-1-methyl-1H-indene?
The IUPAC name of 2,3,4,5-tetrafluoro-1-methyl-1H-indene (CID 126756473) is 2,3,4,5-tetrafluoro-1-methyl-1H-indene.
What is the SMILES notation for 2,3,4,5-tetrafluoro-1-methyl-1H-indene?
The canonical SMILES for 2,3,4,5-tetrafluoro-1-methyl-1H-indene is CC1C(F)=C(F)c2c1ccc(F)c2F.
What is the InChIKey of 2,3,4,5-tetrafluoro-1-methyl-1H-indene?
The InChIKey is KKQDFLSKFRSGGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F4/c1-4-5-2-3-6(11)9(13)7(5)10(14)8(4)12/h2-4H,1H3.
What are the key properties of 2,3,4,5-tetrafluoro-1-methyl-1H-indene?
2,3,4,5-tetrafluoro-1-methyl-1H-indene has a molecular weight of 202.15 g/mol, XLogP of 3.69, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetrafluoro-1-methyl-1H-indene is sourced from PubChem (CID 126756473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).