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5-oxo-4-oxatricyclo[4.2.1.0³,?]nonan-2-yl 2-methylprop-2-enoate

5-oxo-4-oxatricyclo[4.2.1.0³,?]nonan-2-yl 2-methylprop-2-enoate

Formula: C12H14O4

SMILES: CC(=C)C(=O)OC1C2CC3C1OC(=O)C3C2

IUPAC: 5-oxo-4-oxatricyclo[4.2.1.0³,?]nonan-2-yl 2-methylprop-2-enoate

InChI: InChI=1/C12H14O4/c1-5(2)11(13)15-9-6-3-7-8(4-6)12(14)16-10(7)9/h6-10H,1,3-4H2,2H3

Composition: C (64.85%), H (6.35%), O (28.80%)

Molar Mass: 222.24

Atom Count: 30

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 5
Exact Mass 222.089208931
Formal Charge 0
FSP3 0.67
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey JJMQLQLMPJLIPZ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.08
Topological Polar Surface Area 52.6
Polarizability 21.99
Ring Count 3
Rotatable Bond Count 3

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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <14 Days C12H14O4 Quote Only
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