6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene

C10H11F9 — CID 141303830

IUPAC6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene
SMILESCC=C(C)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H11F9/c1-3-6(2)4-5-7(11,12)8(13,14)9(15,16)10(17,18)19/h3H,4-5H2,1-2H3
InChIKeyISNIJAGNALHZOE-UHFFFAOYSA-N
MW302.18 g/mol
LogP5.20
Rot. Bonds5

About 6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene

6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene (PubChem CID 141303830) has the molecular formula C10H11F9 and a molecular weight of 302.18 g/mol. Its IUPAC name is 6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene.

Molecular Properties

Compound Name6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene
PubChem CID141303830
Molecular FormulaC10H11F9
Molecular Weight302.18 g/mol
Exact Mass302.07
IUPAC Name6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene
SMILESCC=C(C)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H11F9/c1-3-6(2)4-5-7(11,12)8(13,14)9(15,16)10(17,18)19/h3H,4-5H2,1-2H3
InChIKeyISNIJAGNALHZOE-UHFFFAOYSA-N
XLogP5.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.18
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene?
The IUPAC name of 6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene (CID 141303830) is 6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene.
What is the SMILES notation for 6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene?
The canonical SMILES for 6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene is CC=C(C)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene?
The InChIKey is ISNIJAGNALHZOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F9/c1-3-6(2)4-5-7(11,12)8(13,14)9(15,16)10(17,18)19/h3H,4-5H2,1-2H3.
What are the key properties of 6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene?
6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene has a molecular weight of 302.18 g/mol, XLogP of 5.20, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6,7,7,8,8,9,9,9-nonafluoro-3-methylnon-2-ene is sourced from PubChem (CID 141303830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).