5,6-difluoro-2-propyl-1H-indene

C12H12F2 — CID 139945533

IUPAC5,6-difluoro-2-propyl-1H-indene
SMILESCCCC1=Cc2cc(F)c(F)cc2C1
InChIInChI=1S/C12H12F2/c1-2-3-8-4-9-6-11(13)12(14)7-10(9)5-8/h4,6-7H,2-3,5H2,1H3
InChIKeyLZIBYIXRHXUBRY-UHFFFAOYSA-N
MW194.22 g/mol
LogP3.70
Rot. Bonds2

About 5,6-difluoro-2-propyl-1H-indene

5,6-difluoro-2-propyl-1H-indene (PubChem CID 139945533) has the molecular formula C12H12F2 and a molecular weight of 194.22 g/mol. Its IUPAC name is 5,6-difluoro-2-propyl-1H-indene.

Molecular Properties

Compound Name5,6-difluoro-2-propyl-1H-indene
PubChem CID139945533
Molecular FormulaC12H12F2
Molecular Weight194.22 g/mol
Exact Mass194.09
IUPAC Name5,6-difluoro-2-propyl-1H-indene
SMILESCCCC1=Cc2cc(F)c(F)cc2C1
InChIInChI=1S/C12H12F2/c1-2-3-8-4-9-6-11(13)12(14)7-10(9)5-8/h4,6-7H,2-3,5H2,1H3
InChIKeyLZIBYIXRHXUBRY-UHFFFAOYSA-N
XLogP3.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.22
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-propyl-6-[2-(3,4,5-trifluorophenyl)ethynyl]-1H-indene
CID 174351372
5-methylsulfonyl-2-propyl-1H-indene
CID 150047261
5,6-difluoro-1H-inden-2-amine
CID 141221685
2-[2,6-difluoro-4-[(4-propylphenyl)methoxy]phenyl]-5,6-difluoro-1H-indene
CID 139967121
2-[2,6-difluoro-4-[2-(4-propylcyclohexyl)ethyl]phenyl]-5,6-difluoro-1H-indene
CID 139967120
5,6-difluoro-2-[4-(4-propylcyclohexyl)cyclohexyl]-1H-indene
CID 139945530
6-[4-[2-(3,5-difluoro-4-isothiocyanatophenyl)ethyl]-3-methylphenyl]-2-propyl-1H-indene
CID 174351492
3-(4-butylphenyl)-6,7-difluoro-1,2-dihydronaphthalene
CID 139961229
3-(4-butyl-2,6-difluorophenyl)-6,7-difluoro-1,2-dihydronaphthalene
CID 139961103
2-[2,6-difluoro-4-[2-(4-pentylcyclohexyl)ethyl]phenyl]-5,6-difluoro-1H-indene
CID 139967211
6-fluoro-7-(4-pentylcyclohexyl)-3-propyl-1,2-dihydronaphthalene
CID 139961393
2-(2-aminoethyl)-3H-inden-5-amine;ethane
CID 142597028

Frequently Asked Questions

What is the IUPAC name of 5,6-difluoro-2-propyl-1H-indene?
The IUPAC name of 5,6-difluoro-2-propyl-1H-indene (CID 139945533) is 5,6-difluoro-2-propyl-1H-indene.
What is the SMILES notation for 5,6-difluoro-2-propyl-1H-indene?
The canonical SMILES for 5,6-difluoro-2-propyl-1H-indene is CCCC1=Cc2cc(F)c(F)cc2C1.
What is the InChIKey of 5,6-difluoro-2-propyl-1H-indene?
The InChIKey is LZIBYIXRHXUBRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F2/c1-2-3-8-4-9-6-11(13)12(14)7-10(9)5-8/h4,6-7H,2-3,5H2,1H3.
What are the key properties of 5,6-difluoro-2-propyl-1H-indene?
5,6-difluoro-2-propyl-1H-indene has a molecular weight of 194.22 g/mol, XLogP of 3.70, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-difluoro-2-propyl-1H-indene is sourced from PubChem (CID 139945533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).