4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine

C14H10F8N2 — CID 134979848

IUPAC4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine
SMILESFC(C1=CC(c2ccccc2)C(C(F)C(F)(F)F)=NN1)C(F)(F)F
InChIInChI=1S/C14H10F8N2/c15-11(13(17,18)19)9-6-8(7-4-2-1-3-5-7)10(24-23-9)12(16)14(20,21)22/h1-6,8,11-12,23H
InChIKeyUXVLKPHGDGJOPZ-UHFFFAOYSA-N
MW358.23 g/mol
LogP4.41
Rot. Bonds3

About 4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine

4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine (PubChem CID 134979848) has the molecular formula C14H10F8N2 and a molecular weight of 358.23 g/mol. Its IUPAC name is 4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine.

Molecular Properties

Compound Name4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine
PubChem CID134979848
Molecular FormulaC14H10F8N2
Molecular Weight358.23 g/mol
Exact Mass358.07
IUPAC Name4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine
SMILESFC(C1=CC(c2ccccc2)C(C(F)C(F)(F)F)=NN1)C(F)(F)F
InChIInChI=1S/C14H10F8N2/c15-11(13(17,18)19)9-6-8(7-4-2-1-3-5-7)10(24-23-9)12(16)14(20,21)22/h1-6,8,11-12,23H
InChIKeyUXVLKPHGDGJOPZ-UHFFFAOYSA-N
XLogP4.41
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.23
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine?
The IUPAC name of 4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine (CID 134979848) is 4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine.
What is the SMILES notation for 4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine?
The canonical SMILES for 4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine is FC(C1=CC(c2ccccc2)C(C(F)C(F)(F)F)=NN1)C(F)(F)F.
What is the InChIKey of 4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine?
The InChIKey is UXVLKPHGDGJOPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F8N2/c15-11(13(17,18)19)9-6-8(7-4-2-1-3-5-7)10(24-23-9)12(16)14(20,21)22/h1-6,8,11-12,23H.
What are the key properties of 4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine?
4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine has a molecular weight of 358.23 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-3,6-bis(1,2,2,2-tetrafluoroethyl)-1,4-dihydropyridazine is sourced from PubChem (CID 134979848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).