6-bromo-8-iodo-2-methoxyquinoline

C10H7BrINO — CID 134968684

IUPAC6-bromo-8-iodo-2-methoxyquinoline
SMILESCOc1ccc2cc(Br)cc(I)c2n1
InChIInChI=1S/C10H7BrINO/c1-14-9-3-2-6-4-7(11)5-8(12)10(6)13-9/h2-5H,1H3
InChIKeyGUIMVXVKVVHMBJ-UHFFFAOYSA-N
MW363.98 g/mol
LogP3.61
Rot. Bonds1

About 6-bromo-8-iodo-2-methoxyquinoline

6-bromo-8-iodo-2-methoxyquinoline (PubChem CID 134968684) has the molecular formula C10H7BrINO and a molecular weight of 363.98 g/mol. Its IUPAC name is 6-bromo-8-iodo-2-methoxyquinoline.

Molecular Properties

Compound Name6-bromo-8-iodo-2-methoxyquinoline
PubChem CID134968684
Molecular FormulaC10H7BrINO
Molecular Weight363.98 g/mol
Exact Mass362.88
IUPAC Name6-bromo-8-iodo-2-methoxyquinoline
SMILESCOc1ccc2cc(Br)cc(I)c2n1
InChIInChI=1S/C10H7BrINO/c1-14-9-3-2-6-4-7(11)5-8(12)10(6)13-9/h2-5H,1H3
InChIKeyGUIMVXVKVVHMBJ-UHFFFAOYSA-N
XLogP3.61
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.98
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-iodo-2-methoxyquinoline?
The IUPAC name of 6-bromo-8-iodo-2-methoxyquinoline (CID 134968684) is 6-bromo-8-iodo-2-methoxyquinoline.
What is the SMILES notation for 6-bromo-8-iodo-2-methoxyquinoline?
The canonical SMILES for 6-bromo-8-iodo-2-methoxyquinoline is COc1ccc2cc(Br)cc(I)c2n1.
What is the InChIKey of 6-bromo-8-iodo-2-methoxyquinoline?
The InChIKey is GUIMVXVKVVHMBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrINO/c1-14-9-3-2-6-4-7(11)5-8(12)10(6)13-9/h2-5H,1H3.
What are the key properties of 6-bromo-8-iodo-2-methoxyquinoline?
6-bromo-8-iodo-2-methoxyquinoline has a molecular weight of 363.98 g/mol, XLogP of 3.61, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-iodo-2-methoxyquinoline is sourced from PubChem (CID 134968684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).