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ethyl 3-oxocyclobutane-1-carboxylate

ethyl 3-oxocyclobutane-1-carboxylate

CAS: 87121-89-9

Formula: C7H10O3

SMILES: CCOC(=O)C1CC(=O)C1

IUPAC: ethyl 3-oxocyclobutane-1-carboxylate

InChI: InChI=1S/C7H10O3/c1-2-10-7(9)5-3-6(8)4-5/h5H,2-4H2,1H3

Composition: C (59.15%), H (7.09%), O (33.76%)

Molar Mass: 142.154

Atom Count: 20

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 142.062994182
Formal Charge 0
FSP3 0.71
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey BXBRFSMPBOTZHJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 34.8
Topological Polar Surface Area 43.37
Polarizability 13.79
Ring Count 1
Rotatable Bond Count 3

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99.94% <7 Days 87121-89-9 $25.25-$499.29$25.25$100.05$499.29
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95% <7 Days 87121-89-9 $7.25-$560.97$7.25$10.35$18.63$35.19$121.10$560.97
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Key Organics Ltd
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95% <2 Days 87121-89-9 $51.35-$612.89$51.35$63.37$86.31$88.49$184.63$612.89
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97% <6 Days 87121-89-9 $6.90-$98.90$6.90$13.80$21.85$26.45$98.90
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95% <14 Days 87121-89-9 $94.50-$236.25$94.50$236.25
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95% <4 Days 87121-89-9 $58.65-$232.30$58.65$232.30
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97% <2 Days 87121-89-9 $51.75-$1,972.25$51.75$155.25$616.40$1,972.25
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