1-bromo-2-iodo-9H-fluorene

C13H8BrI — CID 69464063

IUPAC1-bromo-2-iodo-9H-fluorene
SMILESBrc1c(I)ccc2c1Cc1ccccc1-2
InChIInChI=1S/C13H8BrI/c14-13-11-7-8-3-1-2-4-9(8)10(11)5-6-12(13)15/h1-6H,7H2
InChIKeyCQRGSINAGKMIOX-UHFFFAOYSA-N
MW371.02 g/mol
LogP4.62
Rot. Bonds

About 1-bromo-2-iodo-9H-fluorene

1-bromo-2-iodo-9H-fluorene (PubChem CID 69464063) has the molecular formula C13H8BrI and a molecular weight of 371.02 g/mol. Its IUPAC name is 1-bromo-2-iodo-9H-fluorene.

Molecular Properties

Compound Name1-bromo-2-iodo-9H-fluorene
PubChem CID69464063
Molecular FormulaC13H8BrI
Molecular Weight371.02 g/mol
Exact Mass369.89
IUPAC Name1-bromo-2-iodo-9H-fluorene
SMILESBrc1c(I)ccc2c1Cc1ccccc1-2
InChIInChI=1S/C13H8BrI/c14-13-11-7-8-3-1-2-4-9(8)10(11)5-6-12(13)15/h1-6H,7H2
InChIKeyCQRGSINAGKMIOX-UHFFFAOYSA-N
XLogP4.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.02
LogP ≤ 54.62
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-[2,3,4,5,6-pentakis(9H-fluoren-1-yl)phenyl]-9H-fluorene
CID 141308542
1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
1-bromo-9H-fluorene;1-chloro-4-iodobenzene
CID 118435995
4-(2-bromo-9H-fluoren-1-yl)aniline
CID 175575602
1-(4-iodophenyl)-9H-fluorene
CID 154332097
CID 123562270
CID 123562270
1,2-bis(2-methylphenyl)-9H-fluorene
CID 23369064
1-(9H-fluoren-1-yl)-2,3,4-triphenyl-9H-fluorene
CID 150664526
1,2-bis(tribromomethyl)-9H-fluorene
CID 151330255
azane;hexakis(9H-fluorene)
CID 158472914
9H-fluorene;trihydrofluoride
CID 172854917
cadmium;9H-fluorene
CID 175337736

Frequently Asked Questions

What is the IUPAC name of 1-bromo-2-iodo-9H-fluorene?
The IUPAC name of 1-bromo-2-iodo-9H-fluorene (CID 69464063) is 1-bromo-2-iodo-9H-fluorene.
What is the SMILES notation for 1-bromo-2-iodo-9H-fluorene?
The canonical SMILES for 1-bromo-2-iodo-9H-fluorene is Brc1c(I)ccc2c1Cc1ccccc1-2.
What is the InChIKey of 1-bromo-2-iodo-9H-fluorene?
The InChIKey is CQRGSINAGKMIOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrI/c14-13-11-7-8-3-1-2-4-9(8)10(11)5-6-12(13)15/h1-6H,7H2.
What are the key properties of 1-bromo-2-iodo-9H-fluorene?
1-bromo-2-iodo-9H-fluorene has a molecular weight of 371.02 g/mol, XLogP of 4.62, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-2-iodo-9H-fluorene is sourced from PubChem (CID 69464063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).