9-(3-chlorophenyl)-4,9-diphenylfluorene

C31H21Cl — CID 176760005

IUPAC9-(3-chlorophenyl)-4,9-diphenylfluorene
SMILESClc1cccc(C2(c3ccccc3)c3ccccc3-c3c(-c4ccccc4)cccc32)c1
InChIInChI=1S/C31H21Cl/c32-25-16-9-15-24(21-25)31(23-13-5-2-6-14-23)28-19-8-7-17-27(28)30-26(18-10-20-29(30)31)22-11-3-1-4-12-22/h1-21H
InChIKeySHBLWLSTZLXNEL-UHFFFAOYSA-N
MW428.96 g/mol
LogP8.37
Rot. Bonds3

About 9-(3-chlorophenyl)-4,9-diphenylfluorene

9-(3-chlorophenyl)-4,9-diphenylfluorene (PubChem CID 176760005) has the molecular formula C31H21Cl and a molecular weight of 428.96 g/mol. Its IUPAC name is 9-(3-chlorophenyl)-4,9-diphenylfluorene.

Molecular Properties

Compound Name9-(3-chlorophenyl)-4,9-diphenylfluorene
PubChem CID176760005
Molecular FormulaC31H21Cl
Molecular Weight428.96 g/mol
Exact Mass428.13
IUPAC Name9-(3-chlorophenyl)-4,9-diphenylfluorene
SMILESClc1cccc(C2(c3ccccc3)c3ccccc3-c3c(-c4ccccc4)cccc32)c1
InChIInChI=1S/C31H21Cl/c32-25-16-9-15-24(21-25)31(23-13-5-2-6-14-23)28-19-8-7-17-27(28)30-26(18-10-20-29(30)31)22-11-3-1-4-12-22/h1-21H
InChIKeySHBLWLSTZLXNEL-UHFFFAOYSA-N
XLogP8.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.96
LogP ≤ 58.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 9-(3-chlorophenyl)-4,9-diphenylfluorene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4'-[2-(3-chlorophenyl)phenyl]-9,9'-spirobi[fluorene]
CID 156524901
9-(4-bromophenyl)-9-(3-chlorophenyl)fluorene
CID 176760002
4'-[3-[3-[3-[3-[3-(9,9-diphenylfluoren-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]-9,9'-spirobi[fluorene]
CID 177266011
9-(4-chlorophenyl)-4-naphthalen-2-yl-9-phenylfluorene
CID 176760045
2-(4-chlorophenyl)-4-(9,9-diphenylfluoren-4-yl)-6-phenyl-1,3,5-triazine
CID 167485394
2'-chloro-5'-(3-chlorophenyl)-9,9'-spirobi[fluorene]
CID 137448777
N,N-bis[3-(9,9-diphenylfluoren-4-yl)phenyl]-2-phenylaniline
CID 162510727
4'-[3-[3-[3-[3-[3-(9,9-diphenylfluoren-2-yl)phenyl]phenyl]phenyl]phenyl]-5-phenylphenyl]-9,9'-spirobi[fluorene]
CID 177115837
4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine
CID 164785729
N-[4-(9,9-diphenylspiro[anthracene-10,9'-fluorene]-4'-yl)phenyl]-N,4-diphenylaniline;N-[4-(9,9-diphenylspiro[anthracene-10,9'-fluorene]-4'-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 158824840
3-methyl-5-phenyl-9,9-bis[3-(3-phenylphenyl)phenyl]fluorene
CID 164755332
2-[3-[9-(3-chlorophenyl)fluoren-9-yl]phenyl]pyridine
CID 137452024

Frequently Asked Questions

What is the IUPAC name of 9-(3-chlorophenyl)-4,9-diphenylfluorene?
The IUPAC name of 9-(3-chlorophenyl)-4,9-diphenylfluorene (CID 176760005) is 9-(3-chlorophenyl)-4,9-diphenylfluorene.
What is the SMILES notation for 9-(3-chlorophenyl)-4,9-diphenylfluorene?
The canonical SMILES for 9-(3-chlorophenyl)-4,9-diphenylfluorene is Clc1cccc(C2(c3ccccc3)c3ccccc3-c3c(-c4ccccc4)cccc32)c1.
What is the InChIKey of 9-(3-chlorophenyl)-4,9-diphenylfluorene?
The InChIKey is SHBLWLSTZLXNEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21Cl/c32-25-16-9-15-24(21-25)31(23-13-5-2-6-14-23)28-19-8-7-17-27(28)30-26(18-10-20-29(30)31)22-11-3-1-4-12-22/h1-21H.
What are the key properties of 9-(3-chlorophenyl)-4,9-diphenylfluorene?
9-(3-chlorophenyl)-4,9-diphenylfluorene has a molecular weight of 428.96 g/mol, XLogP of 8.37, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-chlorophenyl)-4,9-diphenylfluorene is sourced from PubChem (CID 176760005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).