1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene

C10H12F6O — CID 57238254

IUPAC1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene
SMILESFC(F)=C(F)CCCOCCCC(F)=C(F)F
InChIInChI=1S/C10H12F6O/c11-7(9(13)14)3-1-5-17-6-2-4-8(12)10(15)16/h1-6H2
InChIKeyNHQCXRFOOBAQPI-UHFFFAOYSA-N
MW262.19 g/mol
LogP4.72
Rot. Bonds8

About 1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene

1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene (PubChem CID 57238254) has the molecular formula C10H12F6O and a molecular weight of 262.19 g/mol. Its IUPAC name is 1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene.

Molecular Properties

Compound Name1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene
PubChem CID57238254
Molecular FormulaC10H12F6O
Molecular Weight262.19 g/mol
Exact Mass262.08
IUPAC Name1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene
SMILESFC(F)=C(F)CCCOCCCC(F)=C(F)F
InChIInChI=1S/C10H12F6O/c11-7(9(13)14)3-1-5-17-6-2-4-8(12)10(15)16/h1-6H2
InChIKeyNHQCXRFOOBAQPI-UHFFFAOYSA-N
XLogP4.72
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.19
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene?
The IUPAC name of 1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene (CID 57238254) is 1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene.
What is the SMILES notation for 1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene?
The canonical SMILES for 1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene is FC(F)=C(F)CCCOCCCC(F)=C(F)F.
What is the InChIKey of 1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene?
The InChIKey is NHQCXRFOOBAQPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F6O/c11-7(9(13)14)3-1-5-17-6-2-4-8(12)10(15)16/h1-6H2.
What are the key properties of 1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene?
1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene has a molecular weight of 262.19 g/mol, XLogP of 4.72, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2-trifluoro-5-(4,5,5-trifluoropent-4-enoxy)pent-1-ene is sourced from PubChem (CID 57238254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).