(5R)-6-oxaspiro[4.5]dec-9-en-4-one

C9H12O2 — CID 102184297

IUPAC(5R)-6-oxaspiro[4.5]dec-9-en-4-one
SMILESO=C1CCC[C@@]12C=CCCO2
InChIInChI=1S/C9H12O2/c10-8-4-3-6-9(8)5-1-2-7-11-9/h1,5H,2-4,6-7H2/t9-/m0/s1
InChIKeyIOGMYCYMUBOGEZ-VIFPVBQESA-N
MW152.19 g/mol
LogP1.45
Rot. Bonds

About (5R)-6-oxaspiro[4.5]dec-9-en-4-one

(5R)-6-oxaspiro[4.5]dec-9-en-4-one (PubChem CID 102184297) has the molecular formula C9H12O2 and a molecular weight of 152.19 g/mol. Its IUPAC name is (5R)-6-oxaspiro[4.5]dec-9-en-4-one.

Molecular Properties

Compound Name(5R)-6-oxaspiro[4.5]dec-9-en-4-one
PubChem CID102184297
Molecular FormulaC9H12O2
Molecular Weight152.19 g/mol
Exact Mass152.08
IUPAC Name(5R)-6-oxaspiro[4.5]dec-9-en-4-one
SMILESO=C1CCC[C@@]12C=CCCO2
InChIInChI=1S/C9H12O2/c10-8-4-3-6-9(8)5-1-2-7-11-9/h1,5H,2-4,6-7H2/t9-/m0/s1
InChIKeyIOGMYCYMUBOGEZ-VIFPVBQESA-N
XLogP1.45
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.19
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-But-2-enyl-3,3,4,4,5,5-hexafluoro-2-prop-2-enoxycyclopentan-1-one
CID 140254564
(5R)-1-oxaspiro[4.4]non-3-en-9-one
CID 101093124
(2R)-2-but-3-enoxy-2-ethenylcyclopentan-1-one
CID 102184295
1-(6-Methyl-2,5-dihydropyran-6-yl)pent-4-en-1-one
CID 10607470
7-Oxabicyclo[2.2.1]hept-2-ene-1,4-dicarbaldehyde
CID 121300732
1-Oxaspiro[4.5]dec-3-en-6-one
CID 14102934
(5S)-1-oxaspiro[4.4]non-3-en-9-one
CID 15891652
1-Oxaspiro[4.4]non-3-en-9-one
CID 15891653
1-Ethoxybicyclo[3.2.0]hept-6-en-2-one
CID 23269150
7-Prop-2-enyl-6-oxaspiro[4.5]dec-8-en-10-one
CID 53391907
(1S,5S)-1-Ethoxybicyclo[3.2.0]hept-6-en-2-one
CID 71372559
1-[(6S)-6-methyl-2,5-dihydropyran-6-yl]pent-4-en-1-one
CID 101079987

Frequently Asked Questions

What is the IUPAC name of (5R)-6-oxaspiro[4.5]dec-9-en-4-one?
The IUPAC name of (5R)-6-oxaspiro[4.5]dec-9-en-4-one (CID 102184297) is (5R)-6-oxaspiro[4.5]dec-9-en-4-one.
What is the SMILES notation for (5R)-6-oxaspiro[4.5]dec-9-en-4-one?
The canonical SMILES for (5R)-6-oxaspiro[4.5]dec-9-en-4-one is O=C1CCC[C@@]12C=CCCO2.
What is the InChIKey of (5R)-6-oxaspiro[4.5]dec-9-en-4-one?
The InChIKey is IOGMYCYMUBOGEZ-VIFPVBQESA-N. The full InChI is InChI=1S/C9H12O2/c10-8-4-3-6-9(8)5-1-2-7-11-9/h1,5H,2-4,6-7H2/t9-/m0/s1.
What are the key properties of (5R)-6-oxaspiro[4.5]dec-9-en-4-one?
(5R)-6-oxaspiro[4.5]dec-9-en-4-one has a molecular weight of 152.19 g/mol, XLogP of 1.45, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-6-oxaspiro[4.5]dec-9-en-4-one is sourced from PubChem (CID 102184297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).