1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene

C7HF13 — CID 11647677

IUPAC1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene
SMILESFC=C(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C7HF13/c8-1-2(9)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)20/h1H
InChIKeyRYSDCNCCQRHRHH-UHFFFAOYSA-N
MW332.06 g/mol
LogP4.87
Rot. Bonds4

About 1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene

1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene (PubChem CID 11647677) has the molecular formula C7HF13 and a molecular weight of 332.06 g/mol. Its IUPAC name is 1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene.

Molecular Properties

Compound Name1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene
PubChem CID11647677
Molecular FormulaC7HF13
Molecular Weight332.06 g/mol
Exact Mass331.99
IUPAC Name1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene
SMILESFC=C(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C7HF13/c8-1-2(9)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)20/h1H
InChIKeyRYSDCNCCQRHRHH-UHFFFAOYSA-N
XLogP4.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.06
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2,3,3,4,4,5,5-Heptafluoro-1-pentene
CID 13750142
3,3,4,4,5,5,6,6,6-Nonafluoro-1-hexene
CID 88054
4,4,5,5,6,6,7,7,7-Nonafluorohepta-1,2-diene
CID 14816571
3,3,4,4,5,5,6,6,7,7,7-Undecafluorohept-1-ene
CID 3019664
1,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooct-1-ene
CID 12824723
1H-Perfluorohex-1-ene
CID 21455498
2,3,3,4,4,5,5,6,6,7,7-Undecafluorohept-1-ene
CID 2776137
(1Z)-1,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooct-1-ene
CID 12835212
(1Z)-1,2,3,3,4,4,5,5,6,6,6-Undecafluorohex-1-ene
CID 14922985
(1E)-1,2,3,3,4,4,5,5,6,6,6-Undecafluorohex-1-ene
CID 71669145
2,3,3,4,4,5,5,6,6,7,7,7-Dodecafluorohept-1-ene
CID 162345575
8-1 Olefin
CID 162345601

Frequently Asked Questions

What is the IUPAC name of 1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene?
The IUPAC name of 1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene (CID 11647677) is 1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene.
What is the SMILES notation for 1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene?
The canonical SMILES for 1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene is FC=C(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene?
The InChIKey is RYSDCNCCQRHRHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7HF13/c8-1-2(9)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)20/h1H.
What are the key properties of 1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene?
1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene has a molecular weight of 332.06 g/mol, XLogP of 4.87, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluorohept-1-ene is sourced from PubChem (CID 11647677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).