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3-(benzyloxy)-2,2-dimethylcyclobutan-1-one

3-(benzyloxy)-2,2-dimethylcyclobutan-1-one

CAS: 2063-92-5

Formula: C13H16O2

SMILES: CC1(C)C(CC1=O)OCC1=CC=CC=C1

IUPAC: 3-(benzyloxy)-2,2-dimethylcyclobutan-1-one

InChI: InChI=1/C13H16O2/c1-13(2)11(14)8-12(13)15-9-10-6-4-3-5-7-10/h3-7,12H,8-9H2,1-2H3

Composition: C (76.44%), H (7.90%), O (15.66%)

Molar Mass: 204.269

Atom Count: 31

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 204.115029755
Formal Charge 0
FSP3 0.46
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey OQYCKJLAKYHLTP-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 58.85
Topological Polar Surface Area 26.3
Polarizability 23.25
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 2063-92-5 $139.32-$1,953.22$139.32$214.12$315.10$441.32$1,196.80$1,953.22
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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 2063-92-5 $61.79-$1,576.25$61.79$122.32$204.28$306.42$945.75$1,576.25
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