1,2-dichlorophenazine

C12H6Cl2N2 — CID 619233

IUPAC1,2-dichlorophenazine
SMILESClc1ccc2nc3ccccc3nc2c1Cl
InChIInChI=1S/C12H6Cl2N2/c13-7-5-6-10-12(11(7)14)16-9-4-2-1-3-8(9)15-10/h1-6H
InChIKeyMUYSJCZHNQPDNG-UHFFFAOYSA-N
MW249.10 g/mol
LogP4.09
Rot. Bonds

About 1,2-dichlorophenazine

1,2-dichlorophenazine (PubChem CID 619233) has the molecular formula C12H6Cl2N2 and a molecular weight of 249.10 g/mol. Its IUPAC name is 1,2-dichlorophenazine.

Molecular Properties

Compound Name1,2-dichlorophenazine
PubChem CID619233
Molecular FormulaC12H6Cl2N2
Molecular Weight249.10 g/mol
Exact Mass247.99
IUPAC Name1,2-dichlorophenazine
SMILESClc1ccc2nc3ccccc3nc2c1Cl
InChIInChI=1S/C12H6Cl2N2/c13-7-5-6-10-12(11(7)14)16-9-4-2-1-3-8(9)15-10/h1-6H
InChIKeyMUYSJCZHNQPDNG-UHFFFAOYSA-N
XLogP4.09
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.10
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,2-dichlorophenazine?
The IUPAC name of 1,2-dichlorophenazine (CID 619233) is 1,2-dichlorophenazine.
What is the SMILES notation for 1,2-dichlorophenazine?
The canonical SMILES for 1,2-dichlorophenazine is Clc1ccc2nc3ccccc3nc2c1Cl.
What is the InChIKey of 1,2-dichlorophenazine?
The InChIKey is MUYSJCZHNQPDNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl2N2/c13-7-5-6-10-12(11(7)14)16-9-4-2-1-3-8(9)15-10/h1-6H.
What are the key properties of 1,2-dichlorophenazine?
1,2-dichlorophenazine has a molecular weight of 249.10 g/mol, XLogP of 4.09, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dichlorophenazine is sourced from PubChem (CID 619233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).