9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole

C37H24IN — CID 67326563

IUPAC9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole
SMILESIc1ccc(C2(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C37H24IN/c38-27-21-17-25(18-22-27)37(33-13-5-1-9-29(33)30-10-2-6-14-34(30)37)26-19-23-28(24-20-26)39-35-15-7-3-11-31(35)32-12-4-8-16-36(32)39/h1-24H
InChIKeyJEDDGPQAJVSRBV-UHFFFAOYSA-N
MW609.51 g/mol
LogP9.75
Rot. Bonds3

About 9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole

9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole (PubChem CID 67326563) has the molecular formula C37H24IN and a molecular weight of 609.51 g/mol. Its IUPAC name is 9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole.

Molecular Properties

Compound Name9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole
PubChem CID67326563
Molecular FormulaC37H24IN
Molecular Weight609.51 g/mol
Exact Mass609.10
IUPAC Name9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole
SMILESIc1ccc(C2(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C37H24IN/c38-27-21-17-25(18-22-27)37(33-13-5-1-9-29(33)30-10-2-6-14-34(30)37)26-19-23-28(24-20-26)39-35-15-7-3-11-31(35)32-12-4-8-16-36(32)39/h1-24H
InChIKeyJEDDGPQAJVSRBV-UHFFFAOYSA-N
XLogP9.75
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500609.51
LogP ≤ 59.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

5-[4-(4-carbazol-9-ylphenyl)phenyl]-11,11-diphenylindeno[1,2-b]carbazole
CID 168783626
3-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]-9-[3-[9-[4-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]phenyl]carbazol-3-yl]phenyl]carbazole
CID 146517009
methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole
CID 158348177
5-[4-[9-[4-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]fluoren-9-yl]phenyl]-[1]benzofuro[3,2-c]carbazole
CID 122548602
3,6-ditert-butyl-9-[4-[9-[4-[9-[4-(3,6-ditert-butylcarbazol-9-yl)phenyl]fluoren-9-yl]phenyl]fluoren-9-yl]phenyl]carbazole
CID 91177168
20-[4-(9,9-diphenylfluoren-4-yl)phenyl]-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14,16,18,21,23-dodecaene
CID 134580544
N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine
CID 121381439
3-[9-[4-[3-[4-[3-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 154590573
9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole
CID 118145084
9-[4-[7'-(4-carbazol-9-ylphenyl)-9,9'-spirobi[fluorene]-2'-yl]phenyl]carbazole
CID 59217021
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(9-phenylfluoren-9-yl)phenyl]-2-(4-phenylphenyl)aniline
CID 121381212
N,4-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N,4-diphenyl-N-[4-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]aniline;9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 158244995

Frequently Asked Questions

What is the IUPAC name of 9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole?
The IUPAC name of 9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole (CID 67326563) is 9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole.
What is the SMILES notation for 9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole?
The canonical SMILES for 9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole is Ic1ccc(C2(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of 9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole?
The InChIKey is JEDDGPQAJVSRBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H24IN/c38-27-21-17-25(18-22-27)37(33-13-5-1-9-29(33)30-10-2-6-14-34(30)37)26-19-23-28(24-20-26)39-35-15-7-3-11-31(35)32-12-4-8-16-36(32)39/h1-24H.
What are the key properties of 9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole?
9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole has a molecular weight of 609.51 g/mol, XLogP of 9.75, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[9-(4-iodophenyl)fluoren-9-yl]phenyl]carbazole is sourced from PubChem (CID 67326563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).