7-bromo-1-chloro-9H-fluorene

C13H8BrCl — CID 170283983

IUPAC7-bromo-1-chloro-9H-fluorene
SMILESClc1cccc2c1Cc1cc(Br)ccc1-2
InChIInChI=1S/C13H8BrCl/c14-9-4-5-10-8(6-9)7-12-11(10)2-1-3-13(12)15/h1-6H,7H2
InChIKeyDHOXNJRWTUVORB-UHFFFAOYSA-N
MW279.56 g/mol
LogP4.67
Rot. Bonds

About 7-bromo-1-chloro-9H-fluorene

7-bromo-1-chloro-9H-fluorene (PubChem CID 170283983) has the molecular formula C13H8BrCl and a molecular weight of 279.56 g/mol. Its IUPAC name is 7-bromo-1-chloro-9H-fluorene.

Molecular Properties

Compound Name7-bromo-1-chloro-9H-fluorene
PubChem CID170283983
Molecular FormulaC13H8BrCl
Molecular Weight279.56 g/mol
Exact Mass277.95
IUPAC Name7-bromo-1-chloro-9H-fluorene
SMILESClc1cccc2c1Cc1cc(Br)ccc1-2
InChIInChI=1S/C13H8BrCl/c14-9-4-5-10-8(6-9)7-12-11(10)2-1-3-13(12)15/h1-6H,7H2
InChIKeyDHOXNJRWTUVORB-UHFFFAOYSA-N
XLogP4.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.56
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-1-chloro-9H-fluorene?
The IUPAC name of 7-bromo-1-chloro-9H-fluorene (CID 170283983) is 7-bromo-1-chloro-9H-fluorene.
What is the SMILES notation for 7-bromo-1-chloro-9H-fluorene?
The canonical SMILES for 7-bromo-1-chloro-9H-fluorene is Clc1cccc2c1Cc1cc(Br)ccc1-2.
What is the InChIKey of 7-bromo-1-chloro-9H-fluorene?
The InChIKey is DHOXNJRWTUVORB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrCl/c14-9-4-5-10-8(6-9)7-12-11(10)2-1-3-13(12)15/h1-6H,7H2.
What are the key properties of 7-bromo-1-chloro-9H-fluorene?
7-bromo-1-chloro-9H-fluorene has a molecular weight of 279.56 g/mol, XLogP of 4.67, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-1-chloro-9H-fluorene is sourced from PubChem (CID 170283983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).