8-bromoquinolin-5-ol

C9H6BrNO — CID 135742169

IUPAC8-bromoquinolin-5-ol
SMILESOc1ccc(Br)c2ncccc12
InChIInChI=1S/C9H6BrNO/c10-7-3-4-8(12)6-2-1-5-11-9(6)7/h1-5,12H
InChIKeyPQDUEAPSAXAQOY-UHFFFAOYSA-N
MW224.06 g/mol
LogP2.70
Rot. Bonds

About 8-bromoquinolin-5-ol

8-bromoquinolin-5-ol (PubChem CID 135742169) has the molecular formula C9H6BrNO and a molecular weight of 224.06 g/mol. Its IUPAC name is 8-bromoquinolin-5-ol.

Molecular Properties

Compound Name8-bromoquinolin-5-ol
PubChem CID135742169
Molecular FormulaC9H6BrNO
Molecular Weight224.06 g/mol
Exact Mass222.96
IUPAC Name8-bromoquinolin-5-ol
SMILESOc1ccc(Br)c2ncccc12
InChIInChI=1S/C9H6BrNO/c10-7-3-4-8(12)6-2-1-5-11-9(6)7/h1-5,12H
InChIKeyPQDUEAPSAXAQOY-UHFFFAOYSA-N
XLogP2.70
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.06
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-bromoquinolin-5-ol?
The IUPAC name of 8-bromoquinolin-5-ol (CID 135742169) is 8-bromoquinolin-5-ol.
What is the SMILES notation for 8-bromoquinolin-5-ol?
The canonical SMILES for 8-bromoquinolin-5-ol is Oc1ccc(Br)c2ncccc12.
What is the InChIKey of 8-bromoquinolin-5-ol?
The InChIKey is PQDUEAPSAXAQOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6BrNO/c10-7-3-4-8(12)6-2-1-5-11-9(6)7/h1-5,12H.
What are the key properties of 8-bromoquinolin-5-ol?
8-bromoquinolin-5-ol has a molecular weight of 224.06 g/mol, XLogP of 2.70, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromoquinolin-5-ol is sourced from PubChem (CID 135742169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).