7,7,8,8-tetrafluorodec-9-ene-2,4-dione

C10H12F4O2 — CID 58864073

IUPAC7,7,8,8-tetrafluorodec-9-ene-2,4-dione
SMILESC=CC(F)(F)C(F)(F)CCC(=O)CC(C)=O
InChIInChI=1S/C10H12F4O2/c1-3-9(11,12)10(13,14)5-4-8(16)6-7(2)15/h3H,1,4-6H2,2H3
InChIKeyJKKXTDOIROWFRR-UHFFFAOYSA-N
MW240.20 g/mol
LogP2.77
Rot. Bonds7

About 7,7,8,8-tetrafluorodec-9-ene-2,4-dione

7,7,8,8-tetrafluorodec-9-ene-2,4-dione (PubChem CID 58864073) has the molecular formula C10H12F4O2 and a molecular weight of 240.20 g/mol. Its IUPAC name is 7,7,8,8-tetrafluorodec-9-ene-2,4-dione.

Molecular Properties

Compound Name7,7,8,8-tetrafluorodec-9-ene-2,4-dione
PubChem CID58864073
Molecular FormulaC10H12F4O2
Molecular Weight240.20 g/mol
Exact Mass240.08
IUPAC Name7,7,8,8-tetrafluorodec-9-ene-2,4-dione
SMILESC=CC(F)(F)C(F)(F)CCC(=O)CC(C)=O
InChIInChI=1S/C10H12F4O2/c1-3-9(11,12)10(13,14)5-4-8(16)6-7(2)15/h3H,1,4-6H2,2H3
InChIKeyJKKXTDOIROWFRR-UHFFFAOYSA-N
XLogP2.77
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.20
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

1,1,1-Trifluorooct-7-ene-2,4-dione
CID 14573424
7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-Heptadecafluorotetradec-1-en-4-one
CID 102001690
1,1,1-Trifluoroundec-10-en-2-one
CID 71485099
1,1,1-Trifluorotridec-12-en-2-one
CID 11322666
6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Pentadecafluorododec-1-en-5-one
CID 14112690
4,4-Difluorotrideca-1,2-dien-6-one
CID 168301382
3,3,4,4-Tetrafluorododec-1-en-5-one
CID 178341188
8-Nonene-2,4-dione
CID 11309626
6,6,7,7,8,8,9,9,10,10,11,11,11-Tridecafluoroundec-1-en-5-one
CID 14973850
1,1-Difluoronon-1-en-4-one
CID 15651616
Methyl 10,10-difluoro-9-decenyl ketone
CID 19915358
1,1,1,2,2-Pentafluorotetradec-13-en-6-one
CID 22033192

Frequently Asked Questions

What is the IUPAC name of 7,7,8,8-tetrafluorodec-9-ene-2,4-dione?
The IUPAC name of 7,7,8,8-tetrafluorodec-9-ene-2,4-dione (CID 58864073) is 7,7,8,8-tetrafluorodec-9-ene-2,4-dione.
What is the SMILES notation for 7,7,8,8-tetrafluorodec-9-ene-2,4-dione?
The canonical SMILES for 7,7,8,8-tetrafluorodec-9-ene-2,4-dione is C=CC(F)(F)C(F)(F)CCC(=O)CC(C)=O.
What is the InChIKey of 7,7,8,8-tetrafluorodec-9-ene-2,4-dione?
The InChIKey is JKKXTDOIROWFRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F4O2/c1-3-9(11,12)10(13,14)5-4-8(16)6-7(2)15/h3H,1,4-6H2,2H3.
What are the key properties of 7,7,8,8-tetrafluorodec-9-ene-2,4-dione?
7,7,8,8-tetrafluorodec-9-ene-2,4-dione has a molecular weight of 240.20 g/mol, XLogP of 2.77, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7,8,8-tetrafluorodec-9-ene-2,4-dione is sourced from PubChem (CID 58864073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).