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

C7HF13 — CID 14922983

IUPAC1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene
SMILESFC(F)=C(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C7HF13/c8-1(2(9)10)4(13,14)6(17,18)7(19,20)5(15,16)3(11)12/h3H
InChIKeyKUFLHRZRGADWRY-UHFFFAOYSA-N
MW332.06 g/mol
LogP4.87
Rot. Bonds5

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

1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene (PubChem CID 14922983) has the molecular formula C7HF13 and a molecular weight of 332.06 g/mol. Its IUPAC name is 1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene.

Molecular Properties

Compound Name1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene
PubChem CID14922983
Molecular FormulaC7HF13
Molecular Weight332.06 g/mol
Exact Mass331.99
IUPAC Name1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene
SMILESFC(F)=C(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F
InChIInChI=1S/C7HF13/c8-1(2(9)10)4(13,14)6(17,18)7(19,20)5(15,16)3(11)12/h3H
InChIKeyKUFLHRZRGADWRY-UHFFFAOYSA-N
XLogP4.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
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'}

Analyze 1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene with MolForge

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

Launch Full Analysis

Related Compounds

1-Heptene, 1,1,2,3,3,4,4,5,5,6,6,7,7,7-tetradecafluoro-
CID 67737
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
1H-Perfluoro-1-heptene
CID 11647677
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
6H-Perfluorohex-1-ene
CID 2776155

Frequently Asked Questions

What is the IUPAC name of 1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene?
The IUPAC name of 1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene (CID 14922983) is 1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene.
What is the SMILES notation for 1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene?
The canonical SMILES for 1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene is FC(F)=C(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)F.
What is the InChIKey of 1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene?
The InChIKey is KUFLHRZRGADWRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7HF13/c8-1(2(9)10)4(13,14)6(17,18)7(19,20)5(15,16)3(11)12/h3H.
What are the key properties of 1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene?
1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene has a molecular weight of 332.06 g/mol, XLogP of 4.87, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3,3,4,4,5,5,6,6,7,7-tridecafluorohept-1-ene is sourced from PubChem (CID 14922983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).