1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane

C7HF15 — CID 9778

IUPAC1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane
SMILESFC(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C7HF15/c8-1(9)2(10,11)3(12,13)4(14,15)5(16,17)6(18,19)7(20,21)22/h1H
InChIKeyHBZVXKDQRIQMCW-UHFFFAOYSA-N
MW370.06 g/mol
LogP4.99
Rot. Bonds5

About 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane

1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane (PubChem CID 9778) has the molecular formula C7HF15 and a molecular weight of 370.06 g/mol. Its IUPAC name is 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane.

Molecular Properties

Compound Name1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane
PubChem CID9778
Molecular FormulaC7HF15
Molecular Weight370.06 g/mol
Exact Mass369.98
IUPAC Name1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane
SMILESFC(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C7HF15/c8-1(9)2(10,11)3(12,13)4(14,15)5(16,17)6(18,19)7(20,21)22/h1H
InChIKeyHBZVXKDQRIQMCW-UHFFFAOYSA-N
XLogP4.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.06
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane?
The IUPAC name of 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane (CID 9778) is 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane.
What is the SMILES notation for 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane?
The canonical SMILES for 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane is FC(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane?
The InChIKey is HBZVXKDQRIQMCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7HF15/c8-1(9)2(10,11)3(12,13)4(14,15)5(16,17)6(18,19)7(20,21)22/h1H.
What are the key properties of 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane?
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane has a molecular weight of 370.06 g/mol, XLogP of 4.99, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoroheptane is sourced from PubChem (CID 9778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).