6-bromo-5-chloro-2-methoxyquinoline

C10H7BrClNO — CID 84713362

IUPAC6-bromo-5-chloro-2-methoxyquinoline
SMILESCOc1ccc2c(Cl)c(Br)ccc2n1
InChIInChI=1S/C10H7BrClNO/c1-14-9-5-2-6-8(13-9)4-3-7(11)10(6)12/h2-5H,1H3
InChIKeyCXVVSMOUTNYAMS-UHFFFAOYSA-N
MW272.53 g/mol
LogP3.66
Rot. Bonds1

About 6-bromo-5-chloro-2-methoxyquinoline

6-bromo-5-chloro-2-methoxyquinoline (PubChem CID 84713362) has the molecular formula C10H7BrClNO and a molecular weight of 272.53 g/mol. Its IUPAC name is 6-bromo-5-chloro-2-methoxyquinoline.

Molecular Properties

Compound Name6-bromo-5-chloro-2-methoxyquinoline
PubChem CID84713362
Molecular FormulaC10H7BrClNO
Molecular Weight272.53 g/mol
Exact Mass270.94
IUPAC Name6-bromo-5-chloro-2-methoxyquinoline
SMILESCOc1ccc2c(Cl)c(Br)ccc2n1
InChIInChI=1S/C10H7BrClNO/c1-14-9-5-2-6-8(13-9)4-3-7(11)10(6)12/h2-5H,1H3
InChIKeyCXVVSMOUTNYAMS-UHFFFAOYSA-N
XLogP3.66
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.53
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-5-chloro-2-methoxyquinoline?
The IUPAC name of 6-bromo-5-chloro-2-methoxyquinoline (CID 84713362) is 6-bromo-5-chloro-2-methoxyquinoline.
What is the SMILES notation for 6-bromo-5-chloro-2-methoxyquinoline?
The canonical SMILES for 6-bromo-5-chloro-2-methoxyquinoline is COc1ccc2c(Cl)c(Br)ccc2n1.
What is the InChIKey of 6-bromo-5-chloro-2-methoxyquinoline?
The InChIKey is CXVVSMOUTNYAMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrClNO/c1-14-9-5-2-6-8(13-9)4-3-7(11)10(6)12/h2-5H,1H3.
What are the key properties of 6-bromo-5-chloro-2-methoxyquinoline?
6-bromo-5-chloro-2-methoxyquinoline has a molecular weight of 272.53 g/mol, XLogP of 3.66, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-5-chloro-2-methoxyquinoline is sourced from PubChem (CID 84713362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).