CAS: 56309-94-5
Name: 4-(1,4-dioxaspiro[4.5]decan-8-yl)cyclohexan-1-one
SMILES:
C1CC(=O)CCC1C2CCC3(CC2)OCCO3Molecular Processing
Molecular formula
C14H22O3
Molecular weight
238.33
Exact mass
238.1569
XLogP
2.68
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
17
Rings
3
Aromatic rings
0
Saturated rings
3
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.929
Molar refractivity
63.56
Supplementary Information
InChIKey: ZNWLFTSPNBLXGL-UHFFFAOYSA-N
Synonyme
4-(1,4-dioxaspiro[4.5]dec-8-yl)cyclohexanone4-(1,4-dioxa-spiro(4.5)dec-8-yl)-cyclohexanone4-(1,4-Dioxa-spiro[4.5]dec-8-yl)-cyclohexanone4-(1,4-Dioxaspiro(4.5)dec-8-yl)cyclohexanoneRefChem:510200423-860-256309-94-54-(1,4-Dioxaspiro[4.5]decan-8-yl)cyclohexanoneKetoketalBicyclohexane-4,4-dione Monoethylene Ketal4-(1,4-dioxaspiro[4.5]decan-8-yl)cyclohexan-1-one8-(4-Oxocyclohexyl)-1,4-dioxaspiro[4.5]decaneMFCD00809704Cyclohexanone, 4-(1,4-dioxaspiro[4.5]dec-8-yl)-C14H22O3Bicyclohexane-4,4'-dione Monoethylene Ketal4-{1,4-DIOXASPIRO[4.5]DECAN-8-YL}CYCLOHEXAN-1-ONECyclohexanone, 4-(1,4-dioxaspiro(4.5)dec-8-yl)-4-(1,4-dioxaspiro[4.5]dec-8-yl)cyclohexan-1-oneBAS 004515724,4'-Dicyclohexanedione monoethylene ketal4,4 inverted exclamation mark -Dicyclohexanedione monoethylene ketalDicyclohexane-4,4'-dione monoethylene ketalEC 423-860-2Oprea1_121109Oprea1_868255SCHEMBL422994CHEMBL5307540DTXSID10355639HMS1672N02
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