(E)-4-(trifluoromethyl)tetradec-3-ene

C15H27F3 — CID 11536279

IUPAC(E)-4-(trifluoromethyl)tetradec-3-ene
SMILESCC/C=C(\CCCCCCCCCC)C(F)(F)F
InChIInChI=1S/C15H27F3/c1-3-5-6-7-8-9-10-11-13-14(12-4-2)15(16,17)18/h12H,3-11,13H2,1-2H3/b14-12+
InChIKeyMUCHVRKEYAKIIS-WYMLVPIESA-N
MW264.37 g/mol
LogP6.42
Rot. Bonds10

About (E)-4-(trifluoromethyl)tetradec-3-ene

(E)-4-(trifluoromethyl)tetradec-3-ene (PubChem CID 11536279) has the molecular formula C15H27F3 and a molecular weight of 264.37 g/mol. Its IUPAC name is (E)-4-(trifluoromethyl)tetradec-3-ene.

Molecular Properties

Compound Name(E)-4-(trifluoromethyl)tetradec-3-ene
PubChem CID11536279
Molecular FormulaC15H27F3
Molecular Weight264.37 g/mol
Exact Mass264.21
IUPAC Name(E)-4-(trifluoromethyl)tetradec-3-ene
SMILESCC/C=C(\CCCCCCCCCC)C(F)(F)F
InChIInChI=1S/C15H27F3/c1-3-5-6-7-8-9-10-11-13-14(12-4-2)15(16,17)18/h12H,3-11,13H2,1-2H3/b14-12+
InChIKeyMUCHVRKEYAKIIS-WYMLVPIESA-N
XLogP6.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.37
LogP ≤ 56.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(Z)-4-(trifluoromethyl)hept-3-ene
CID 174331610
4-(triethoxymethyl)dodec-3-ene
CID 152586980
(E)-3-(trifluoromethyl)oct-2-enoic acid
CID 82534928
4-fluoroundec-3-ene
CID 141013194
4-tert-butyloct-3-ene
CID 123879820
4-methylheptadec-3-ene
CID 59169426
(Z)-dodec-3-en-4-amine
CID 21249690
2-fluoro-2-methyldecan-3-one
CID 14645302
2-propylidenedecane-1,1-diol
CID 174657973
N-methylnonadec-3-en-4-amine
CID 174311135
1,1,1-trifluoro-2-(trifluoromethyl)dec-2-ene
CID 123613644
4-propylnon-3-ene
CID 57321984

Frequently Asked Questions

What is the IUPAC name of (E)-4-(trifluoromethyl)tetradec-3-ene?
The IUPAC name of (E)-4-(trifluoromethyl)tetradec-3-ene (CID 11536279) is (E)-4-(trifluoromethyl)tetradec-3-ene.
What is the SMILES notation for (E)-4-(trifluoromethyl)tetradec-3-ene?
The canonical SMILES for (E)-4-(trifluoromethyl)tetradec-3-ene is CC/C=C(\CCCCCCCCCC)C(F)(F)F.
What is the InChIKey of (E)-4-(trifluoromethyl)tetradec-3-ene?
The InChIKey is MUCHVRKEYAKIIS-WYMLVPIESA-N. The full InChI is InChI=1S/C15H27F3/c1-3-5-6-7-8-9-10-11-13-14(12-4-2)15(16,17)18/h12H,3-11,13H2,1-2H3/b14-12+.
What are the key properties of (E)-4-(trifluoromethyl)tetradec-3-ene?
(E)-4-(trifluoromethyl)tetradec-3-ene has a molecular weight of 264.37 g/mol, XLogP of 6.42, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-(trifluoromethyl)tetradec-3-ene is sourced from PubChem (CID 11536279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).