2-bromo-6-chloronaphthalene

C10H6BrCl — CID 53485707

IUPAC2-bromo-6-chloronaphthalene
SMILESClc1ccc2cc(Br)ccc2c1
InChIInChI=1S/C10H6BrCl/c11-9-3-1-8-6-10(12)4-2-7(8)5-9/h1-6H
InChIKeyNDDRCPBWWONGJR-UHFFFAOYSA-N
MW241.52 g/mol
LogP4.26
Rot. Bonds

About 2-bromo-6-chloronaphthalene

2-bromo-6-chloronaphthalene (PubChem CID 53485707) has the molecular formula C10H6BrCl and a molecular weight of 241.52 g/mol. Its IUPAC name is 2-bromo-6-chloronaphthalene.

Molecular Properties

Compound Name2-bromo-6-chloronaphthalene
PubChem CID53485707
Molecular FormulaC10H6BrCl
Molecular Weight241.52 g/mol
Exact Mass239.93
IUPAC Name2-bromo-6-chloronaphthalene
SMILESClc1ccc2cc(Br)ccc2c1
InChIInChI=1S/C10H6BrCl/c11-9-3-1-8-6-10(12)4-2-7(8)5-9/h1-6H
InChIKeyNDDRCPBWWONGJR-UHFFFAOYSA-N
XLogP4.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.52
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-chloronaphthalene?
The IUPAC name of 2-bromo-6-chloronaphthalene (CID 53485707) is 2-bromo-6-chloronaphthalene.
What is the SMILES notation for 2-bromo-6-chloronaphthalene?
The canonical SMILES for 2-bromo-6-chloronaphthalene is Clc1ccc2cc(Br)ccc2c1.
What is the InChIKey of 2-bromo-6-chloronaphthalene?
The InChIKey is NDDRCPBWWONGJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrCl/c11-9-3-1-8-6-10(12)4-2-7(8)5-9/h1-6H.
What are the key properties of 2-bromo-6-chloronaphthalene?
2-bromo-6-chloronaphthalene has a molecular weight of 241.52 g/mol, XLogP of 4.26, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-chloronaphthalene is sourced from PubChem (CID 53485707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).