(1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum

C8F12Pt — CID 87582607

IUPAC(1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum
SMILESF/C1=C(\F)C(F)(F)C(F)(F)/C(F)=C(/F)C(F)(F)C1(F)F.[Pt]
InChIInChI=1S/C8F12.Pt/c9-1-2(10)6(15,16)8(19,20)4(12)3(11)7(17,18)5(1,13)14;/b2-1-,4-3-;
InChIKeyIKZDCVYPUXVULC-MEOHMOSHSA-N
MW519.14 g/mol
LogP4.84
Rot. Bonds

About (1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum

(1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum (PubChem CID 87582607) has the molecular formula C8F12Pt and a molecular weight of 519.14 g/mol. Its IUPAC name is (1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum.

Molecular Properties

Compound Name(1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum
PubChem CID87582607
Molecular FormulaC8F12Pt
Molecular Weight519.14 g/mol
Exact Mass518.95
IUPAC Name(1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum
SMILESF/C1=C(\F)C(F)(F)C(F)(F)/C(F)=C(/F)C(F)(F)C1(F)F.[Pt]
InChIInChI=1S/C8F12.Pt/c9-1-2(10)6(15,16)8(19,20)4(12)3(11)7(17,18)5(1,13)14;/b2-1-,4-3-;
InChIKeyIKZDCVYPUXVULC-MEOHMOSHSA-N
XLogP4.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500519.14
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum?
The IUPAC name of (1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum (CID 87582607) is (1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum.
What is the SMILES notation for (1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum?
The canonical SMILES for (1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum is F/C1=C(\F)C(F)(F)C(F)(F)/C(F)=C(/F)C(F)(F)C1(F)F.[Pt].
What is the InChIKey of (1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum?
The InChIKey is IKZDCVYPUXVULC-MEOHMOSHSA-N. The full InChI is InChI=1S/C8F12.Pt/c9-1-2(10)6(15,16)8(19,20)4(12)3(11)7(17,18)5(1,13)14;/b2-1-,4-3-;.
What are the key properties of (1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum?
(1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum has a molecular weight of 519.14 g/mol, XLogP of 4.84, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,5Z)-1,2,3,3,4,4,5,6,7,7,8,8-dodecafluorocycloocta-1,5-diene;platinum is sourced from PubChem (CID 87582607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).