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(2E)-4-{bicyclo[2.2.1]heptan-2-yloxy}-4-oxobut-2-enoic acid

(2E)-4-{bicyclo[2.2.1]heptan-2-yloxy}-4-oxobut-2-enoic acid

Formula: C11H14O4

SMILES: OC(=O)C=CC(=O)OC1CC2CCC1C2

IUPAC: (2E)-4-{bicyclo[2.2.1]heptan-2-yloxy}-4-oxobut-2-enoic acid

InChI: InChI=1/C11H14O4/c12-10(13)3-4-11(14)15-9-6-7-1-2-8(9)5-7/h3-4,7-9H,1-2,5-6H2,(H,12,13)/b4-3+

Composition: C (62.85%), H (6.71%), O (30.44%)

Molar Mass: 210.229

Atom Count: 29

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 3
Exact Mass 210.089208931
Formal Charge 0
FSP3 0.64
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey LYWHMRGFYPLVAT-ONEGZZNKNA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.01
Topological Polar Surface Area 63.6
Polarizability 20.64
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C11H14O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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