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2-oxaspiro[4.5]decane-1,3-dione

2-oxaspiro[4.5]decane-1,3-dione

Formula: C9H12O3

SMILES: O=C1CC2(CCCCC2)C(=O)O1

IUPAC: 2-oxaspiro[4.5]decane-1,3-dione

InChI: InChI=1S/C9H12O3/c10-7-6-9(8(11)12-7)4-2-1-3-5-9/h1-6H2

Composition: C (64.27%), H (7.19%), O (28.54%)

Molar Mass: 168.192

Atom Count: 24

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 168.078644246
Formal Charge 0
FSP3 0.78
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey MIASZRJCZPRMBI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 41.41
Topological Polar Surface Area 43.37
Polarizability 16.73
Ring Count 2
Rotatable Bond Count 0

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Purity LeadTime Formula UnitPrice
98% <10 Days C9H12O3 Quote Only