2,7-dichloroquinoxaline

C8H4Cl2N2 — CID 2758223

IUPAC2,7-dichloroquinoxaline
SMILESClc1ccc2ncc(Cl)nc2c1
InChIInChI=1S/C8H4Cl2N2/c9-5-1-2-6-7(3-5)12-8(10)4-11-6/h1-4H
InChIKeyYNASAKVGUCRNEP-UHFFFAOYSA-N
MW199.04 g/mol
LogP2.94
Rot. Bonds

About 2,7-dichloroquinoxaline

2,7-dichloroquinoxaline (PubChem CID 2758223) has the molecular formula C8H4Cl2N2 and a molecular weight of 199.04 g/mol. Its IUPAC name is 2,7-dichloroquinoxaline.

Molecular Properties

Compound Name2,7-dichloroquinoxaline
PubChem CID2758223
Molecular FormulaC8H4Cl2N2
Molecular Weight199.04 g/mol
Exact Mass197.98
IUPAC Name2,7-dichloroquinoxaline
SMILESClc1ccc2ncc(Cl)nc2c1
InChIInChI=1S/C8H4Cl2N2/c9-5-1-2-6-7(3-5)12-8(10)4-11-6/h1-4H
InChIKeyYNASAKVGUCRNEP-UHFFFAOYSA-N
XLogP2.94
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.04
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,7-dichloroquinoxaline?
The IUPAC name of 2,7-dichloroquinoxaline (CID 2758223) is 2,7-dichloroquinoxaline.
What is the SMILES notation for 2,7-dichloroquinoxaline?
The canonical SMILES for 2,7-dichloroquinoxaline is Clc1ccc2ncc(Cl)nc2c1.
What is the InChIKey of 2,7-dichloroquinoxaline?
The InChIKey is YNASAKVGUCRNEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4Cl2N2/c9-5-1-2-6-7(3-5)12-8(10)4-11-6/h1-4H.
What are the key properties of 2,7-dichloroquinoxaline?
2,7-dichloroquinoxaline has a molecular weight of 199.04 g/mol, XLogP of 2.94, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dichloroquinoxaline is sourced from PubChem (CID 2758223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).