6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine

C6H6N2O2 — CID 89029422

IUPAC6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine
SMILESc1cc2c(nn1)OCCO2
InChIInChI=1S/C6H6N2O2/c1-2-7-8-6-5(1)9-3-4-10-6/h1-2H,3-4H2
InChIKeyGSBNHPMPEBPESH-UHFFFAOYSA-N
MW138.13 g/mol
LogP0.25
Rot. Bonds

About 6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine

6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine (PubChem CID 89029422) has the molecular formula C6H6N2O2 and a molecular weight of 138.13 g/mol. Its IUPAC name is 6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine.

Molecular Properties

Compound Name6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine
PubChem CID89029422
Molecular FormulaC6H6N2O2
Molecular Weight138.13 g/mol
Exact Mass138.04
IUPAC Name6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine
SMILESc1cc2c(nn1)OCCO2
InChIInChI=1S/C6H6N2O2/c1-2-7-8-6-5(1)9-3-4-10-6/h1-2H,3-4H2
InChIKeyGSBNHPMPEBPESH-UHFFFAOYSA-N
XLogP0.25
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.13
LogP ≤ 50.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine?
The IUPAC name of 6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine (CID 89029422) is 6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine.
What is the SMILES notation for 6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine?
The canonical SMILES for 6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine is c1cc2c(nn1)OCCO2.
What is the InChIKey of 6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine?
The InChIKey is GSBNHPMPEBPESH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N2O2/c1-2-7-8-6-5(1)9-3-4-10-6/h1-2H,3-4H2.
What are the key properties of 6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine?
6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine has a molecular weight of 138.13 g/mol, XLogP of 0.25, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-[1,4]dioxino[2,3-c]pyridazine is sourced from PubChem (CID 89029422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).