2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene

C32H21F3 — CID 151214779

IUPAC2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene
SMILESFC(F)(F)c1ccc(-c2c3c(cc(-c4ccccc4)c2-c2ccccc2)-c2ccccc2C3)cc1
InChIInChI=1S/C32H21F3/c33-32(34,35)25-17-15-23(16-18-25)31-29-19-24-13-7-8-14-26(24)28(29)20-27(21-9-3-1-4-10-21)30(31)22-11-5-2-6-12-22/h1-18,20H,19H2
InChIKeyNLAFVJOINBZVAF-UHFFFAOYSA-N
MW462.51 g/mol
LogP9.28
Rot. Bonds3

About 2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene

2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene (PubChem CID 151214779) has the molecular formula C32H21F3 and a molecular weight of 462.51 g/mol. Its IUPAC name is 2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene.

Molecular Properties

Compound Name2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene
PubChem CID151214779
Molecular FormulaC32H21F3
Molecular Weight462.51 g/mol
Exact Mass462.16
IUPAC Name2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene
SMILESFC(F)(F)c1ccc(-c2c3c(cc(-c4ccccc4)c2-c2ccccc2)-c2ccccc2C3)cc1
InChIInChI=1S/C32H21F3/c33-32(34,35)25-17-15-23(16-18-25)31-29-19-24-13-7-8-14-26(24)28(29)20-27(21-9-3-1-4-10-21)30(31)22-11-5-2-6-12-22/h1-18,20H,19H2
InChIKeyNLAFVJOINBZVAF-UHFFFAOYSA-N
XLogP9.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500462.51
LogP ≤ 59.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,3-bis(3,5-dimethylphenyl)-1-(4-fluorophenyl)-9H-fluorene
CID 151991768
1-[2-(2,3-diphenyl-9H-fluoren-1-yl)ethenyl]-2,3-diphenyl-9H-fluorene
CID 150549233
2,3-diphenyl-1-(4-phenylsulfanylphenyl)-9H-fluorene;fluoroform;1,1,2,2,2-pentafluoroethyl dihydrogen phosphate
CID 161234986
1-(9H-fluoren-9-yl)-2,3-diphenyl-9H-fluorene
CID 150323539
1-phenyl-9H-fluorene;4-(trifluoromethyl)benzenesulfonic acid
CID 158777181
4-methylbenzenesulfonic acid;3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-1,2-diphenyl-9H-fluorene
CID 172859889
2-fluoro-1-phenyl-9H-fluorene
CID 151671400
1-(2,3-dimethyl-9H-fluoren-1-yl)-2,3-diphenylanthracene
CID 166544861
1,2-diphenyl-3-propyl-9H-fluorene
CID 174971839
1-(4-fluorophenyl)-2,3,4-triphenyl-9H-fluorene
CID 150980192
1,1'-biphenyl;4-[1-(4-hydroxyphenyl)-9H-fluoren-2-yl]phenol
CID 174876060
N-[4-(2,3-dimethyl-9H-fluoren-1-yl)phenyl]-4-phenylaniline
CID 175031439

Frequently Asked Questions

What is the IUPAC name of 2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene?
The IUPAC name of 2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene (CID 151214779) is 2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene.
What is the SMILES notation for 2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene?
The canonical SMILES for 2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene is FC(F)(F)c1ccc(-c2c3c(cc(-c4ccccc4)c2-c2ccccc2)-c2ccccc2C3)cc1.
What is the InChIKey of 2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene?
The InChIKey is NLAFVJOINBZVAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H21F3/c33-32(34,35)25-17-15-23(16-18-25)31-29-19-24-13-7-8-14-26(24)28(29)20-27(21-9-3-1-4-10-21)30(31)22-11-5-2-6-12-22/h1-18,20H,19H2.
What are the key properties of 2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene?
2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene has a molecular weight of 462.51 g/mol, XLogP of 9.28, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diphenyl-1-[4-(trifluoromethyl)phenyl]-9H-fluorene is sourced from PubChem (CID 151214779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).