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1,4-dioxaspiro[4.5]decan-7-one

1,4-dioxaspiro[4.5]decan-7-one

CAS: 4969-01-1

Formula: C8H12O3

SMILES: O=C1CCCC2(C1)OCCO2

IUPAC: 1,4-dioxaspiro[4.5]decan-7-one

InChI: InChI=1S/C8H12O3/c9-7-2-1-3-8(6-7)10-4-5-11-8/h1-6H2

Composition: C (61.52%), H (7.74%), O (30.73%)

Molar Mass: 156.181

Atom Count: 23

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 156.078644246
Formal Charge 0
FSP3 0.87
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey TVXYCOHQUCHFAM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.87
Topological Polar Surface Area 35.53
Polarizability 15.51
Ring Count 2
Rotatable Bond Count 0

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