6-bromoquinoxaline

C8H5BrN2 — CID 610939

IUPAC6-bromoquinoxaline
SMILESBrc1ccc2nccnc2c1
InChIInChI=1S/C8H5BrN2/c9-6-1-2-7-8(5-6)11-4-3-10-7/h1-5H
InChIKeyNOYFLUFQGFNMRB-UHFFFAOYSA-N
MW209.05 g/mol
LogP2.39
Rot. Bonds

About 6-bromoquinoxaline

6-bromoquinoxaline (PubChem CID 610939) has the molecular formula C8H5BrN2 and a molecular weight of 209.05 g/mol. Its IUPAC name is 6-bromoquinoxaline.

Molecular Properties

Compound Name6-bromoquinoxaline
PubChem CID610939
Molecular FormulaC8H5BrN2
Molecular Weight209.05 g/mol
Exact Mass207.96
IUPAC Name6-bromoquinoxaline
SMILESBrc1ccc2nccnc2c1
InChIInChI=1S/C8H5BrN2/c9-6-1-2-7-8(5-6)11-4-3-10-7/h1-5H
InChIKeyNOYFLUFQGFNMRB-UHFFFAOYSA-N
XLogP2.39
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.05
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Quinoxaline
CID 7045
2-Methylquinoxaline
CID 23686
2-Tribromomethylquinoxaline
CID 96377
5-Bromoquinoxalin-6-amine
CID 14928442
2-Chloroquinoxaline
CID 238938
5-Bromoquinolin-8-amine hydrochloride
CID 16192748
N-(5-Bromoquinoxalin-6-yl)guanidine
CID 14928441
2-Quinoxalineacetonitrile
CID 290794
2-(Trifluoromethyl)quinoxaline
CID 10352693
Quinoxaline, 1-oxide
CID 23363
5-Bromoquinoxaline
CID 610437
2-(4-Bromophenyl)quinoxaline
CID 762079

Frequently Asked Questions

What is the IUPAC name of 6-bromoquinoxaline?
The IUPAC name of 6-bromoquinoxaline (CID 610939) is 6-bromoquinoxaline.
What is the SMILES notation for 6-bromoquinoxaline?
The canonical SMILES for 6-bromoquinoxaline is Brc1ccc2nccnc2c1.
What is the InChIKey of 6-bromoquinoxaline?
The InChIKey is NOYFLUFQGFNMRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5BrN2/c9-6-1-2-7-8(5-6)11-4-3-10-7/h1-5H.
What are the key properties of 6-bromoquinoxaline?
6-bromoquinoxaline has a molecular weight of 209.05 g/mol, XLogP of 2.39, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromoquinoxaline is sourced from PubChem (CID 610939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).