1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane

C10H10F12 — CID 175798759

IUPAC1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane
SMILESCCCCC(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H10F12/c1-2-3-4-5(11)6(12,13)7(14,15)8(16,17)9(18,19)10(20,21)22/h5H,2-4H2,1H3
InChIKeySJHDERLDTYEPBA-UHFFFAOYSA-N
MW358.17 g/mol
LogP5.62
Rot. Bonds7

About 1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane

1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane (PubChem CID 175798759) has the molecular formula C10H10F12 and a molecular weight of 358.17 g/mol. Its IUPAC name is 1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane.

Molecular Properties

Compound Name1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane
PubChem CID175798759
Molecular FormulaC10H10F12
Molecular Weight358.17 g/mol
Exact Mass358.06
IUPAC Name1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane
SMILESCCCCC(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C10H10F12/c1-2-3-4-5(11)6(12,13)7(14,15)8(16,17)9(18,19)10(20,21)22/h5H,2-4H2,1H3
InChIKeySJHDERLDTYEPBA-UHFFFAOYSA-N
XLogP5.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.17
LogP ≤ 55.62
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 1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane?
The IUPAC name of 1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane (CID 175798759) is 1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane.
What is the SMILES notation for 1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane?
The canonical SMILES for 1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane is CCCCC(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane?
The InChIKey is SJHDERLDTYEPBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F12/c1-2-3-4-5(11)6(12,13)7(14,15)8(16,17)9(18,19)10(20,21)22/h5H,2-4H2,1H3.
What are the key properties of 1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane?
1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane has a molecular weight of 358.17 g/mol, XLogP of 5.62, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2,2,3,3,4,4,5,5,6-dodecafluorodecane is sourced from PubChem (CID 175798759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).