(7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione

C16H24O4 — CID 10286146

IUPAC(7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione
SMILESO=C1/C=C/CCCCCC/C=C/C(=O)COCCOC1
InChIInChI=1S/C16H24O4/c17-15-9-7-5-3-1-2-4-6-8-10-16(18)14-20-12-11-19-13-15/h7-10H,1-6,11-14H2/b9-7+,10-8+
InChIKeyHCVRZTNVJSLNCF-FIFLTTCUSA-N
MW280.36 g/mol
LogP2.62
Rot. Bonds

About (7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione

(7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione (PubChem CID 10286146) has the molecular formula C16H24O4 and a molecular weight of 280.36 g/mol. Its IUPAC name is (7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione.

Molecular Properties

Compound Name(7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione
PubChem CID10286146
Molecular FormulaC16H24O4
Molecular Weight280.36 g/mol
Exact Mass280.17
IUPAC Name(7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione
SMILESO=C1/C=C/CCCCCC/C=C/C(=O)COCCOC1
InChIInChI=1S/C16H24O4/c17-15-9-7-5-3-1-2-4-6-8-10-16(18)14-20-12-11-19-13-15/h7-10H,1-6,11-14H2/b9-7+,10-8+
InChIKeyHCVRZTNVJSLNCF-FIFLTTCUSA-N
XLogP2.62
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.36
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione?
The IUPAC name of (7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione (CID 10286146) is (7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione.
What is the SMILES notation for (7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione?
The canonical SMILES for (7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione is O=C1/C=C/CCCCCC/C=C/C(=O)COCCOC1.
What is the InChIKey of (7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione?
The InChIKey is HCVRZTNVJSLNCF-FIFLTTCUSA-N. The full InChI is InChI=1S/C16H24O4/c17-15-9-7-5-3-1-2-4-6-8-10-16(18)14-20-12-11-19-13-15/h7-10H,1-6,11-14H2/b9-7+,10-8+.
What are the key properties of (7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione?
(7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione has a molecular weight of 280.36 g/mol, XLogP of 2.62, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7E,15E)-1,4-dioxacyclooctadeca-7,15-diene-6,17-dione is sourced from PubChem (CID 10286146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).