(7-bromo-9H-fluoren-1-yl) hypochlorite

C13H8BrClO — CID 168875407

IUPAC(7-bromo-9H-fluoren-1-yl) hypochlorite
SMILESClOc1cccc2c1Cc1cc(Br)ccc1-2
InChIInChI=1S/C13H8BrClO/c14-9-4-5-10-8(6-9)7-12-11(10)2-1-3-13(12)16-15/h1-6H,7H2
InChIKeyWHEDCLCRXYQSDN-UHFFFAOYSA-N
MW295.56 g/mol
LogP4.55
Rot. Bonds1

About (7-bromo-9H-fluoren-1-yl) hypochlorite

(7-bromo-9H-fluoren-1-yl) hypochlorite (PubChem CID 168875407) has the molecular formula C13H8BrClO and a molecular weight of 295.56 g/mol. Its IUPAC name is (7-bromo-9H-fluoren-1-yl) hypochlorite.

Molecular Properties

Compound Name(7-bromo-9H-fluoren-1-yl) hypochlorite
PubChem CID168875407
Molecular FormulaC13H8BrClO
Molecular Weight295.56 g/mol
Exact Mass293.94
IUPAC Name(7-bromo-9H-fluoren-1-yl) hypochlorite
SMILESClOc1cccc2c1Cc1cc(Br)ccc1-2
InChIInChI=1S/C13H8BrClO/c14-9-4-5-10-8(6-9)7-12-11(10)2-1-3-13(12)16-15/h1-6H,7H2
InChIKeyWHEDCLCRXYQSDN-UHFFFAOYSA-N
XLogP4.55
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.56
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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4,6-bis[2-(3-bromophenyl)-9H-fluoren-1-yl]dibenzofuran
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(2,7-dibromo-9H-fluoren-1-yl)methylcarbamic acid
CID 174857044
7-bromo-2-hexyl-1-[2,3,4,5,6-pentakis(7-bromo-2-hexyl-9H-fluoren-1-yl)phenyl]-9H-fluorene
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Frequently Asked Questions

What is the IUPAC name of (7-bromo-9H-fluoren-1-yl) hypochlorite?
The IUPAC name of (7-bromo-9H-fluoren-1-yl) hypochlorite (CID 168875407) is (7-bromo-9H-fluoren-1-yl) hypochlorite.
What is the SMILES notation for (7-bromo-9H-fluoren-1-yl) hypochlorite?
The canonical SMILES for (7-bromo-9H-fluoren-1-yl) hypochlorite is ClOc1cccc2c1Cc1cc(Br)ccc1-2.
What is the InChIKey of (7-bromo-9H-fluoren-1-yl) hypochlorite?
The InChIKey is WHEDCLCRXYQSDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrClO/c14-9-4-5-10-8(6-9)7-12-11(10)2-1-3-13(12)16-15/h1-6H,7H2.
What are the key properties of (7-bromo-9H-fluoren-1-yl) hypochlorite?
(7-bromo-9H-fluoren-1-yl) hypochlorite has a molecular weight of 295.56 g/mol, XLogP of 4.55, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7-bromo-9H-fluoren-1-yl) hypochlorite is sourced from PubChem (CID 168875407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).