1,2-bis(tribromomethyl)-9H-fluorene

C15H8Br6 — CID 151330255

IUPAC1,2-bis(tribromomethyl)-9H-fluorene
SMILESBrC(Br)(Br)c1ccc2c(c1C(Br)(Br)Br)Cc1ccccc1-2
InChIInChI=1S/C15H8Br6/c16-14(17,18)12-6-5-10-9-4-2-1-3-8(9)7-11(10)13(12)15(19,20)21/h1-6H,7H2
InChIKeyOIHPTYPLNUFFJW-UHFFFAOYSA-N
MW667.65 g/mol
LogP7.85
Rot. Bonds

About 1,2-bis(tribromomethyl)-9H-fluorene

1,2-bis(tribromomethyl)-9H-fluorene (PubChem CID 151330255) has the molecular formula C15H8Br6 and a molecular weight of 667.65 g/mol. Its IUPAC name is 1,2-bis(tribromomethyl)-9H-fluorene.

Molecular Properties

Compound Name1,2-bis(tribromomethyl)-9H-fluorene
PubChem CID151330255
Molecular FormulaC15H8Br6
Molecular Weight667.65 g/mol
Exact Mass661.57
IUPAC Name1,2-bis(tribromomethyl)-9H-fluorene
SMILESBrC(Br)(Br)c1ccc2c(c1C(Br)(Br)Br)Cc1ccccc1-2
InChIInChI=1S/C15H8Br6/c16-14(17,18)12-6-5-10-9-4-2-1-3-8(9)7-11(10)13(12)15(19,20)21/h1-6H,7H2
InChIKeyOIHPTYPLNUFFJW-UHFFFAOYSA-N
XLogP7.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500667.65
LogP ≤ 57.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
1-tert-butyl-2-phenyl-9H-fluorene
CID 172750922
1-[2,3,4,5,6-pentakis(9H-fluoren-1-yl)phenyl]-9H-fluorene
CID 141308542
1-[2-(9H-fluoren-1-yl)but-3-yn-2-yl]-9H-fluorene
CID 151464335
1-bromo-2-iodo-9H-fluorene
CID 69464063
CID 123562270
CID 123562270
1-[9H-fluoren-1-yl(diphenyl)methyl]-9H-fluorene
CID 141254702
cadmium;9H-fluorene
CID 175337736
azane;hexakis(9H-fluorene)
CID 158472914
9H-fluorene;trihydrofluoride
CID 172854917
chromium;9H-fluorene
CID 161167703
Fluorenylsilane
CID 22104606

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(tribromomethyl)-9H-fluorene?
The IUPAC name of 1,2-bis(tribromomethyl)-9H-fluorene (CID 151330255) is 1,2-bis(tribromomethyl)-9H-fluorene.
What is the SMILES notation for 1,2-bis(tribromomethyl)-9H-fluorene?
The canonical SMILES for 1,2-bis(tribromomethyl)-9H-fluorene is BrC(Br)(Br)c1ccc2c(c1C(Br)(Br)Br)Cc1ccccc1-2.
What is the InChIKey of 1,2-bis(tribromomethyl)-9H-fluorene?
The InChIKey is OIHPTYPLNUFFJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8Br6/c16-14(17,18)12-6-5-10-9-4-2-1-3-8(9)7-11(10)13(12)15(19,20)21/h1-6H,7H2.
What are the key properties of 1,2-bis(tribromomethyl)-9H-fluorene?
1,2-bis(tribromomethyl)-9H-fluorene has a molecular weight of 667.65 g/mol, XLogP of 7.85, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(tribromomethyl)-9H-fluorene is sourced from PubChem (CID 151330255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).