3-[4-(trifluoromethyl)phenyl]-1H-indene

C16H11F3 — CID 90234386

IUPAC3-[4-(trifluoromethyl)phenyl]-1H-indene
SMILESFC(F)(F)c1ccc(C2=CCc3ccccc32)cc1
InChIInChI=1S/C16H11F3/c17-16(18,19)13-8-5-12(6-9-13)15-10-7-11-3-1-2-4-14(11)15/h1-6,8-10H,7H2
InChIKeyBIRWKMONWCAIOX-UHFFFAOYSA-N
MW260.26 g/mol
LogP4.69
Rot. Bonds1

About 3-[4-(trifluoromethyl)phenyl]-1H-indene

3-[4-(trifluoromethyl)phenyl]-1H-indene (PubChem CID 90234386) has the molecular formula C16H11F3 and a molecular weight of 260.26 g/mol. Its IUPAC name is 3-[4-(trifluoromethyl)phenyl]-1H-indene.

Molecular Properties

Compound Name3-[4-(trifluoromethyl)phenyl]-1H-indene
PubChem CID90234386
Molecular FormulaC16H11F3
Molecular Weight260.26 g/mol
Exact Mass260.08
IUPAC Name3-[4-(trifluoromethyl)phenyl]-1H-indene
SMILESFC(F)(F)c1ccc(C2=CCc3ccccc32)cc1
InChIInChI=1S/C16H11F3/c17-16(18,19)13-8-5-12(6-9-13)15-10-7-11-3-1-2-4-14(11)15/h1-6,8-10H,7H2
InChIKeyBIRWKMONWCAIOX-UHFFFAOYSA-N
XLogP4.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.26
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3-(4-fluorophenyl)-1H-indene
CID 15158872
3-(3,4-difluorophenyl)-1H-indene
CID 90234204
3-[4-(trifluoromethyl)phenyl]-4H-isoquinolin-1-one
CID 69179510
3-[3H-inden-1-yl-[4-(trifluoromethyl)phenyl]methylidene]indol-1-ium
CID 158155661
2-[4-(trifluoromethyl)phenyl]phenol
CID 11230142
[2-[4-(trifluoromethyl)phenyl]phenyl]phosphane
CID 138671682
3-(4-chloro-3-methoxyphenyl)-1H-indene
CID 14371616
[3-(3H-inden-1-yl)phenyl]methanamine
CID 174763400
2-[3-[4-(trifluoromethyl)phenyl]inden-1-ylidene]tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene
CID 51033295
1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine
CID 54911995
2-[4-(trifluoromethyl)phenyl]-1H-indene;zirconium
CID 174374188
2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene
CID 151214779

Frequently Asked Questions

What is the IUPAC name of 3-[4-(trifluoromethyl)phenyl]-1H-indene?
The IUPAC name of 3-[4-(trifluoromethyl)phenyl]-1H-indene (CID 90234386) is 3-[4-(trifluoromethyl)phenyl]-1H-indene.
What is the SMILES notation for 3-[4-(trifluoromethyl)phenyl]-1H-indene?
The canonical SMILES for 3-[4-(trifluoromethyl)phenyl]-1H-indene is FC(F)(F)c1ccc(C2=CCc3ccccc32)cc1.
What is the InChIKey of 3-[4-(trifluoromethyl)phenyl]-1H-indene?
The InChIKey is BIRWKMONWCAIOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F3/c17-16(18,19)13-8-5-12(6-9-13)15-10-7-11-3-1-2-4-14(11)15/h1-6,8-10H,7H2.
What are the key properties of 3-[4-(trifluoromethyl)phenyl]-1H-indene?
3-[4-(trifluoromethyl)phenyl]-1H-indene has a molecular weight of 260.26 g/mol, XLogP of 4.69, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(trifluoromethyl)phenyl]-1H-indene is sourced from PubChem (CID 90234386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).