9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene

C37H22Br4 — CID 164755471

IUPAC9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene
SMILESBrc1cc(Br)cc(C2(c3cc(Br)cc(Br)c3)c3cc(-c4ccccc4)ccc3-c3c(-c4ccccc4)cccc32)c1
InChIInChI=1S/C37H22Br4/c38-28-17-26(18-29(39)21-28)37(27-19-30(40)22-31(41)20-27)34-13-7-12-32(24-10-5-2-6-11-24)36(34)33-15-14-25(16-35(33)37)23-8-3-1-4-9-23/h1-22H
InChIKeyLFVAIFNRRNGPMA-UHFFFAOYSA-N
MW786.20 g/mol
LogP12.43
Rot. Bonds4

About 9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene

9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene (PubChem CID 164755471) has the molecular formula C37H22Br4 and a molecular weight of 786.20 g/mol. Its IUPAC name is 9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene.

Molecular Properties

Compound Name9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene
PubChem CID164755471
Molecular FormulaC37H22Br4
Molecular Weight786.20 g/mol
Exact Mass781.85
IUPAC Name9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene
SMILESBrc1cc(Br)cc(C2(c3cc(Br)cc(Br)c3)c3cc(-c4ccccc4)ccc3-c3c(-c4ccccc4)cccc32)c1
InChIInChI=1S/C37H22Br4/c38-28-17-26(18-29(39)21-28)37(27-19-30(40)22-31(41)20-27)34-13-7-12-32(24-10-5-2-6-11-24)36(34)33-15-14-25(16-35(33)37)23-8-3-1-4-9-23/h1-22H
InChIKeyLFVAIFNRRNGPMA-UHFFFAOYSA-N
XLogP12.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500786.20
LogP ≤ 512.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 9,9-bis(3,5-dibromophenyl)-2,5-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

9',9'-bis(3,5-dibromophenyl)-6'-phenylspiro[fluorene-9,14'-pentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene]
CID 164755510
9,9-bis(3-bromophenyl)-5-(2-methylphenyl)-2-phenylfluorene
CID 164755389
9,9-bis(3,5-dibromophenyl)-3-methyl-5-phenylfluorene
CID 164755474
9,9-bis(3,5-dibromophenyl)-5-phenylindeno[1,2-f][1,3]benzodioxole
CID 164755597
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-[3-[3-(9,9-diphenylfluoren-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]-9,9'-spirobi[fluorene]
CID 177266011
14,14-bis(3,5-dibromophenyl)-17-phenyl-9-oxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaene
CID 154647072
4'-[3-(4-bromophenyl)phenyl]-9,9'-spirobi[fluorene]
CID 165158281
9,9-bis(3,5-dibromophenyl)-5-(2-phenylphenyl)indeno[1,2-f][1,3]benzodioxole
CID 164755562
4,9-diphenyl-9-[4-(5,7,7-triphenylcyclobuta[a]inden-2-yl)phenyl]fluorene;ethane
CID 144938868
4-[2-[3-[3-[3-[3-[3-phenyl-5-(9,9'-spirobi[fluorene]-4'-yl)phenyl]phenyl]phenyl]phenyl]phenyl]-9-pyridin-4-ylfluoren-9-yl]pyridine
CID 177115865
9,9-diphenyl-2-[3-(3-phenylphenyl)phenyl]fluorene
CID 154591168

Frequently Asked Questions

What is the IUPAC name of 9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene?
The IUPAC name of 9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene (CID 164755471) is 9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene.
What is the SMILES notation for 9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene?
The canonical SMILES for 9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene is Brc1cc(Br)cc(C2(c3cc(Br)cc(Br)c3)c3cc(-c4ccccc4)ccc3-c3c(-c4ccccc4)cccc32)c1.
What is the InChIKey of 9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene?
The InChIKey is LFVAIFNRRNGPMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H22Br4/c38-28-17-26(18-29(39)21-28)37(27-19-30(40)22-31(41)20-27)34-13-7-12-32(24-10-5-2-6-11-24)36(34)33-15-14-25(16-35(33)37)23-8-3-1-4-9-23/h1-22H.
What are the key properties of 9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene?
9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene has a molecular weight of 786.20 g/mol, XLogP of 12.43, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-bis(3,5-dibromophenyl)-2,5-diphenylfluorene is sourced from PubChem (CID 164755471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).