5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene

C10H9F11 — CID 141192184

IUPAC5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene
SMILESCC=C(C)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H9F11/c1-3-5(2)4-6(11,12)7(13,14)8(15,16)9(17,18)10(19,20)21/h3H,4H2,1-2H3
InChIKeyIDHJMJFGZAJQDX-UHFFFAOYSA-N
MW338.16 g/mol
LogP5.45
Rot. Bonds5

About 5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene

5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene (PubChem CID 141192184) has the molecular formula C10H9F11 and a molecular weight of 338.16 g/mol. Its IUPAC name is 5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene.

Molecular Properties

Compound Name5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene
PubChem CID141192184
Molecular FormulaC10H9F11
Molecular Weight338.16 g/mol
Exact Mass338.05
IUPAC Name5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene
SMILESCC=C(C)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H9F11/c1-3-5(2)4-6(11,12)7(13,14)8(15,16)9(17,18)10(19,20)21/h3H,4H2,1-2H3
InChIKeyIDHJMJFGZAJQDX-UHFFFAOYSA-N
XLogP5.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.16
LogP ≤ 55.45
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 5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene?
The IUPAC name of 5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene (CID 141192184) is 5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene.
What is the SMILES notation for 5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene?
The canonical SMILES for 5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene is CC=C(C)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene?
The InChIKey is IDHJMJFGZAJQDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F11/c1-3-5(2)4-6(11,12)7(13,14)8(15,16)9(17,18)10(19,20)21/h3H,4H2,1-2H3.
What are the key properties of 5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene?
5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene has a molecular weight of 338.16 g/mol, XLogP of 5.45, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,6,6,7,7,8,8,9,9,9-undecafluoro-3-methylnon-2-ene is sourced from PubChem (CID 141192184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).