3,9,9-triphenylfluorene

C31H22 — CID 140844354

IUPAC3,9,9-triphenylfluorene
SMILESc1ccc(-c2ccc3c(c2)-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C31H22/c1-4-12-23(13-5-1)24-20-21-30-28(22-24)27-18-10-11-19-29(27)31(30,25-14-6-2-7-15-25)26-16-8-3-9-17-26/h1-22H
InChIKeyXVVNECGUAMRBRY-UHFFFAOYSA-N
MW394.52 g/mol
LogP7.72
Rot. Bonds3

About 3,9,9-triphenylfluorene

3,9,9-triphenylfluorene (PubChem CID 140844354) has the molecular formula C31H22 and a molecular weight of 394.52 g/mol. Its IUPAC name is 3,9,9-triphenylfluorene.

Molecular Properties

Compound Name3,9,9-triphenylfluorene
PubChem CID140844354
Molecular FormulaC31H22
Molecular Weight394.52 g/mol
Exact Mass394.17
IUPAC Name3,9,9-triphenylfluorene
SMILESc1ccc(-c2ccc3c(c2)-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C31H22/c1-4-12-23(13-5-1)24-20-21-30-28(22-24)27-18-10-11-19-29(27)31(30,25-14-6-2-7-15-25)26-16-8-3-9-17-26/h1-22H
InChIKeyXVVNECGUAMRBRY-UHFFFAOYSA-N
XLogP7.72
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.52
LogP ≤ 57.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-[4-[4-(9,9-diphenylfluoren-3-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 121450656
N-[4-(9,9-diphenylfluoren-3-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 118155143
3,3'-diphenyl-9,9'-spirobi[fluorene]
CID 58789520
methane;3-phenyl-9,9'-spirobi[fluorene]
CID 145237340
N,N-bis[3-(9,9-diphenylfluoren-3-yl)phenyl]-3-phenylaniline
CID 162510714
2-(9,9-diphenylfluoren-3-yl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 122416353
4-[4-[4-(9,9-diphenylfluoren-3-yl)phenyl]phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine
CID 134272105
9,9-diphenyl-2-[3-(3-phenylphenyl)phenyl]fluorene
CID 154591168
3-(9,9-diphenylfluoren-3-yl)-N-[3-(9,9-diphenylfluoren-3-yl)phenyl]-N-phenylaniline
CID 162510737
2-[3-(9,9-diphenylfluoren-3-yl)phenyl]-4,6-diphenylpyridine
CID 134272003
2-(9,9-diphenylfluoren-3-yl)-4-(3,5-diphenylphenyl)-6-phenyl-1,3,5-triazine
CID 162196090
2-[2-[9-[2-(9,9'-spirobi[fluorene]-2-yl)phenyl]fluoren-9-yl]phenyl]-9,9'-spirobi[fluorene];2-[3-[9-[3-(9,9'-spirobi[fluorene]-2-yl)phenyl]fluoren-9-yl]phenyl]-9,9'-spirobi[fluorene];3-[3-[9-[3-(9,9'-spirobi[fluorene]-3-yl)phenyl]fluoren-9-yl]phenyl]-9,9'-spirobi[fluorene];3-[4-[9-[4-(9,9'-spirobi[fluorene]-3-yl)phenyl]fluoren-9-yl]phenyl]-9,9'-spirobi[fluorene]
CID 158592384

Frequently Asked Questions

What is the IUPAC name of 3,9,9-triphenylfluorene?
The IUPAC name of 3,9,9-triphenylfluorene (CID 140844354) is 3,9,9-triphenylfluorene.
What is the SMILES notation for 3,9,9-triphenylfluorene?
The canonical SMILES for 3,9,9-triphenylfluorene is c1ccc(-c2ccc3c(c2)-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 3,9,9-triphenylfluorene?
The InChIKey is XVVNECGUAMRBRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H22/c1-4-12-23(13-5-1)24-20-21-30-28(22-24)27-18-10-11-19-29(27)31(30,25-14-6-2-7-15-25)26-16-8-3-9-17-26/h1-22H.
What are the key properties of 3,9,9-triphenylfluorene?
3,9,9-triphenylfluorene has a molecular weight of 394.52 g/mol, XLogP of 7.72, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,9,9-triphenylfluorene is sourced from PubChem (CID 140844354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).