1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene

C14F26 — CID 138396244

IUPAC1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene
SMILESFC(=C(F)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F)C(F)(F)C(F)(F)C(F)=C(F)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C14F26/c15-1(5(9(23,24)25,10(26,27)28)11(29,30)31)3(17)7(19,20)8(21,22)4(18)2(16)6(12(32,33)34,13(35,36)37)14(38,39)40
InChIKeyAVAVXFBRAQABKB-UHFFFAOYSA-N
MW662.10 g/mol
LogP9.90
Rot. Bonds5

About 1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene

1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene (PubChem CID 138396244) has the molecular formula C14F26 and a molecular weight of 662.10 g/mol. Its IUPAC name is 1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene.

Molecular Properties

Compound Name1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene
PubChem CID138396244
Molecular FormulaC14F26
Molecular Weight662.10 g/mol
Exact Mass661.96
IUPAC Name1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene
SMILESFC(=C(F)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F)C(F)(F)C(F)(F)C(F)=C(F)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C14F26/c15-1(5(9(23,24)25,10(26,27)28)11(29,30)31)3(17)7(19,20)8(21,22)4(18)2(16)6(12(32,33)34,13(35,36)37)14(38,39)40
InChIKeyAVAVXFBRAQABKB-UHFFFAOYSA-N
XLogP9.90
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500662.10
LogP ≤ 59.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene?
The IUPAC name of 1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene (CID 138396244) is 1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene.
What is the SMILES notation for 1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene?
The canonical SMILES for 1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene is FC(=C(F)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F)C(F)(F)C(F)(F)C(F)=C(F)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F.
What is the InChIKey of 1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene?
The InChIKey is AVAVXFBRAQABKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14F26/c15-1(5(9(23,24)25,10(26,27)28)11(29,30)31)3(17)7(19,20)8(21,22)4(18)2(16)6(12(32,33)34,13(35,36)37)14(38,39)40.
What are the key properties of 1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene?
1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene has a molecular weight of 662.10 g/mol, XLogP of 9.90, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,3,4,5,5,6,6,7,8,10,10,10-tetradecafluoro-2,2,9,9-tetrakis(trifluoromethyl)deca-3,7-diene is sourced from PubChem (CID 138396244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).