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4-(tert-butoxy)cyclohexan-1-one

4-(tert-butoxy)cyclohexan-1-one

CAS: 69697-43-4

Formula: C10H18O2

SMILES: CC(C)(C)OC1CCC(=O)CC1

IUPAC: 4-(tert-butoxy)cyclohexan-1-one

InChI: InChI=1S/C10H18O2/c1-10(2,3)12-9-6-4-8(11)5-7-9/h9H,4-7H2,1-3H3

Composition: C (70.55%), H (10.66%), O (18.79%)

Molar Mass: 170.252

Atom Count: 30

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 170.13067982
Formal Charge 0
FSP3 0.9
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey QJKVFGKPHOTMIU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.47
Topological Polar Surface Area 26.3
Polarizability 19.18
Ring Count 1
Rotatable Bond Count 2

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97% <2 Days 69697-43-4 $221.95-$5,612.00$221.95$327.75$540.50$966.00$1,587.00$5,612.00
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