7-oxaspiro[4.5]dec-8-en-6-one

C9H12O2 — CID 138373736

IUPAC7-oxaspiro[4.5]dec-8-en-6-one
SMILESO=C1OC=CCC12CCCC2
InChIInChI=1S/C9H12O2/c10-8-9(4-1-2-5-9)6-3-7-11-8/h3,7H,1-2,4-6H2
InChIKeyHIGCQNVDAOBYED-UHFFFAOYSA-N
MW152.19 g/mol
LogP2.01
Rot. Bonds

About 7-oxaspiro[4.5]dec-8-en-6-one

7-oxaspiro[4.5]dec-8-en-6-one (PubChem CID 138373736) has the molecular formula C9H12O2 and a molecular weight of 152.19 g/mol. Its IUPAC name is 7-oxaspiro[4.5]dec-8-en-6-one.

Molecular Properties

Compound Name7-oxaspiro[4.5]dec-8-en-6-one
PubChem CID138373736
Molecular FormulaC9H12O2
Molecular Weight152.19 g/mol
Exact Mass152.08
IUPAC Name7-oxaspiro[4.5]dec-8-en-6-one
SMILESO=C1OC=CCC12CCCC2
InChIInChI=1S/C9H12O2/c10-8-9(4-1-2-5-9)6-3-7-11-8/h3,7H,1-2,4-6H2
InChIKeyHIGCQNVDAOBYED-UHFFFAOYSA-N
XLogP2.01
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 ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Ethyl 2-ethyl-2-prop-2-enylhexanoate
CID 15311378
Cyclo-pentyl dihydropyran-2-one
CID 69043480
Methyl 1-Allylcyclopentanecarboxylate
CID 14976613
(4R)-4-(2-methylpropyl)-3,4-dihydropyran-2-one
CID 102448097
Ethyl 1-prop-2-enylcyclopentane-1-carboxylate
CID 134988082
Ethenyl 2-ethenyl-2-ethylhexanoate
CID 17909990
1-(3-Butenyl)Cyclopentane Carboxylic Acid Methyl Ester
CID 23384162
Methyl 2-(1-prop-2-enylcyclopentyl)acetate
CID 58592988
Butyl 1-prop-2-enylcyclopentane-1-carboxylate
CID 89200911
Ethyl 2-ethyl-2-prop-2-enylhept-6-enoate
CID 89658614
Hex-1-enyl 2-ethylhexanoate
CID 174161921
3-Butyl-3,4-dihydropyran-2-one
CID 21116176

Frequently Asked Questions

What is the IUPAC name of 7-oxaspiro[4.5]dec-8-en-6-one?
The IUPAC name of 7-oxaspiro[4.5]dec-8-en-6-one (CID 138373736) is 7-oxaspiro[4.5]dec-8-en-6-one.
What is the SMILES notation for 7-oxaspiro[4.5]dec-8-en-6-one?
The canonical SMILES for 7-oxaspiro[4.5]dec-8-en-6-one is O=C1OC=CCC12CCCC2.
What is the InChIKey of 7-oxaspiro[4.5]dec-8-en-6-one?
The InChIKey is HIGCQNVDAOBYED-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12O2/c10-8-9(4-1-2-5-9)6-3-7-11-8/h3,7H,1-2,4-6H2.
What are the key properties of 7-oxaspiro[4.5]dec-8-en-6-one?
7-oxaspiro[4.5]dec-8-en-6-one has a molecular weight of 152.19 g/mol, XLogP of 2.01, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-oxaspiro[4.5]dec-8-en-6-one is sourced from PubChem (CID 138373736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).