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2-oxaspiro[4.5]decane-1,6-dione

2-oxaspiro[4.5]decane-1,6-dione

CAS: 345914-29-6

Formula: C9H12O3

SMILES: O=C1OCCC11CCCCC1=O

IUPAC: 2-oxaspiro[4.5]decane-1,6-dione

InChI: InChI=1/C9H12O3/c10-7-3-1-2-4-9(7)5-6-12-8(9)11/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 1
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 AXWDOKOHCDNZPV-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 42.08
Topological Polar Surface Area 43.37
Polarizability 16.73
Ring Count 2
Rotatable Bond Count 0

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97% <2 Days 345914-29-6 $342.70-$5,747.70$342.70$457.70$687.70$977.50$1,587.00$5,747.70
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