1-(4-iodophenyl)-9H-fluorene

C19H13I — CID 154332097

IUPAC1-(4-iodophenyl)-9H-fluorene
SMILESIc1ccc(-c2cccc3c2Cc2ccccc2-3)cc1
InChIInChI=1S/C19H13I/c20-15-10-8-13(9-11-15)16-6-3-7-18-17-5-2-1-4-14(17)12-19(16)18/h1-11H,12H2
InChIKeyKIQQEUGUCQBCOO-UHFFFAOYSA-N
MW368.22 g/mol
LogP5.53
Rot. Bonds1

About 1-(4-iodophenyl)-9H-fluorene

1-(4-iodophenyl)-9H-fluorene (PubChem CID 154332097) has the molecular formula C19H13I and a molecular weight of 368.22 g/mol. Its IUPAC name is 1-(4-iodophenyl)-9H-fluorene.

Molecular Properties

Compound Name1-(4-iodophenyl)-9H-fluorene
PubChem CID154332097
Molecular FormulaC19H13I
Molecular Weight368.22 g/mol
Exact Mass368.01
IUPAC Name1-(4-iodophenyl)-9H-fluorene
SMILESIc1ccc(-c2cccc3c2Cc2ccccc2-3)cc1
InChIInChI=1S/C19H13I/c20-15-10-8-13(9-11-15)16-6-3-7-18-17-5-2-1-4-14(17)12-19(16)18/h1-11H,12H2
InChIKeyKIQQEUGUCQBCOO-UHFFFAOYSA-N
XLogP5.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.22
LogP ≤ 55.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
1-[2-(4-phenylphenyl)phenyl]-9H-fluorene
CID 174460318
4-(9H-fluoren-1-yl)benzonitrile
CID 154389455
N-[4-(9H-fluoren-1-yl)phenyl]-4-[4-(N-[4-(9H-fluoren-1-yl)phenyl]anilino)phenyl]-N-phenylaniline
CID 157272103
1-[2,3,4,5,6-pentakis(9H-fluoren-1-yl)phenyl]-9H-fluorene
CID 141308542
2,11-bis(9H-fluoren-1-yl)triphenylene
CID 59489264
4-[4-(9H-fluoren-1-yl)phenoxy]aniline
CID 141303700
2-(9H-fluoren-1-yl)anthracene
CID 151119003
1-bromo-9H-fluorene;1-chloro-4-iodobenzene
CID 118435995
1-[4-[4-methyl-3-(2-methylphenyl)phenyl]phenyl]-9H-fluorene
CID 145108730
2-[[4-(9H-fluoren-1-yl)phenyl]methyl]oxirane
CID 175054294
9-(3,5-dimethylphenyl)-10-[4-(9H-fluoren-1-yl)phenyl]anthracene
CID 143811504

Frequently Asked Questions

What is the IUPAC name of 1-(4-iodophenyl)-9H-fluorene?
The IUPAC name of 1-(4-iodophenyl)-9H-fluorene (CID 154332097) is 1-(4-iodophenyl)-9H-fluorene.
What is the SMILES notation for 1-(4-iodophenyl)-9H-fluorene?
The canonical SMILES for 1-(4-iodophenyl)-9H-fluorene is Ic1ccc(-c2cccc3c2Cc2ccccc2-3)cc1.
What is the InChIKey of 1-(4-iodophenyl)-9H-fluorene?
The InChIKey is KIQQEUGUCQBCOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13I/c20-15-10-8-13(9-11-15)16-6-3-7-18-17-5-2-1-4-14(17)12-19(16)18/h1-11H,12H2.
What are the key properties of 1-(4-iodophenyl)-9H-fluorene?
1-(4-iodophenyl)-9H-fluorene has a molecular weight of 368.22 g/mol, XLogP of 5.53, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-iodophenyl)-9H-fluorene is sourced from PubChem (CID 154332097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).