6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene

C11H11F11 — CID 174938660

IUPAC6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene
SMILESCC=C(C)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C11H11F11/c1-3-6(2)4-5-7(12,13)8(14,15)9(16,17)10(18,19)11(20,21)22/h3H,4-5H2,1-2H3
InChIKeyZXXSOMSTMCVVNK-UHFFFAOYSA-N
MW352.19 g/mol
LogP5.84
Rot. Bonds6

About 6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene

6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene (PubChem CID 174938660) has the molecular formula C11H11F11 and a molecular weight of 352.19 g/mol. Its IUPAC name is 6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene.

Molecular Properties

Compound Name6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene
PubChem CID174938660
Molecular FormulaC11H11F11
Molecular Weight352.19 g/mol
Exact Mass352.07
IUPAC Name6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene
SMILESCC=C(C)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C11H11F11/c1-3-6(2)4-5-7(12,13)8(14,15)9(16,17)10(18,19)11(20,21)22/h3H,4-5H2,1-2H3
InChIKeyZXXSOMSTMCVVNK-UHFFFAOYSA-N
XLogP5.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.19
LogP ≤ 55.84
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 6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene?
The IUPAC name of 6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene (CID 174938660) is 6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene.
What is the SMILES notation for 6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene?
The canonical SMILES for 6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene is CC=C(C)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene?
The InChIKey is ZXXSOMSTMCVVNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F11/c1-3-6(2)4-5-7(12,13)8(14,15)9(16,17)10(18,19)11(20,21)22/h3H,4-5H2,1-2H3.
What are the key properties of 6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene?
6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene has a molecular weight of 352.19 g/mol, XLogP of 5.84, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6,7,7,8,8,9,9,10,10,10-undecafluoro-3-methyldec-2-ene is sourced from PubChem (CID 174938660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).