spiro[4.5]deca-2,8-diene-4,10-dione

C10H10O2 — CID 15499878

IUPACspiro[4.5]deca-2,8-diene-4,10-dione
SMILESO=C1C=CCCC12CC=CC2=O
InChIInChI=1S/C10H10O2/c11-8-4-1-2-6-10(8)7-3-5-9(10)12/h1,3-5H,2,6-7H2
InChIKeyRRFNMQVTUFNUBO-UHFFFAOYSA-N
MW162.19 g/mol
LogP1.42
Rot. Bonds

About spiro[4.5]deca-2,8-diene-4,10-dione

spiro[4.5]deca-2,8-diene-4,10-dione (PubChem CID 15499878) has the molecular formula C10H10O2 and a molecular weight of 162.19 g/mol. Its IUPAC name is spiro[4.5]deca-2,8-diene-4,10-dione.

Molecular Properties

Compound Namespiro[4.5]deca-2,8-diene-4,10-dione
PubChem CID15499878
Molecular FormulaC10H10O2
Molecular Weight162.19 g/mol
Exact Mass162.07
IUPAC Namespiro[4.5]deca-2,8-diene-4,10-dione
SMILESO=C1C=CCCC12CC=CC2=O
InChIInChI=1S/C10H10O2/c11-8-4-1-2-6-10(8)7-3-5-9(10)12/h1,3-5H,2,6-7H2
InChIKeyRRFNMQVTUFNUBO-UHFFFAOYSA-N
XLogP1.42
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tricyclo[4.4.1.01,6]undeca-3,8-diene-2,7-dione
CID 130031205
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CID 101464848
6-methyl-6-prop-2-enylcyclohex-2-en-1-one
CID 13024680
(5R)-5-methyl-5-(4-methylphenyl)cyclopent-2-en-1-one
CID 102317256
3,3-dimethyl-2,4-dioxaspiro[5.6]dodec-9-ene-1,5-dione
CID 172588066
spiro[5.5]undeca-1,4,9-trien-3-one
CID 12641997
spiro[3.4]oct-6-ene-1,3-dione
CID 55296259
6-(3-chlorobut-2-enyl)-6-methylcyclohex-2-en-1-one
CID 131879044
1'-methylspiro[cyclohexene-4,3'-indole]-2'-one
CID 12024416
(6R)-6-(3-methoxyphenyl)-6-(methylamino)cyclohex-2-en-1-one
CID 138575946
7-oxadispiro[4.0.46.45]tetradec-12-en-11-one
CID 14932389
(2E,6E,10Z,14E)-cyclopentadeca-2,6,10,14-tetraen-1-one
CID 22818646

Frequently Asked Questions

What is the IUPAC name of spiro[4.5]deca-2,8-diene-4,10-dione?
The IUPAC name of spiro[4.5]deca-2,8-diene-4,10-dione (CID 15499878) is spiro[4.5]deca-2,8-diene-4,10-dione.
What is the SMILES notation for spiro[4.5]deca-2,8-diene-4,10-dione?
The canonical SMILES for spiro[4.5]deca-2,8-diene-4,10-dione is O=C1C=CCCC12CC=CC2=O.
What is the InChIKey of spiro[4.5]deca-2,8-diene-4,10-dione?
The InChIKey is RRFNMQVTUFNUBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O2/c11-8-4-1-2-6-10(8)7-3-5-9(10)12/h1,3-5H,2,6-7H2.
What are the key properties of spiro[4.5]deca-2,8-diene-4,10-dione?
spiro[4.5]deca-2,8-diene-4,10-dione has a molecular weight of 162.19 g/mol, XLogP of 1.42, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[4.5]deca-2,8-diene-4,10-dione is sourced from PubChem (CID 15499878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).