(1S,2S,3S,6R,7R,9S)-2-hydroxy-5-oxo-4-oxatricyclo[4.2.1.0³,⁷]nonane-9-carboxylic acid | C9H10O5 | MFCD30491690 | O[C@H]1[C@H]2C[C@H]3[C@@H]1OC(=O)[C@H]3[C@H]2C(O)=O | BBV-108869022, CSC043445747, FCH9014869 | Chemspace

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Home CSCS00043445747

Structure Info

Chemspace ID: CSCS00043445747 (Synthesis)

MFCD: MFCD30491690

IUPAC Name: (1S,2S,3S,6R,7R,9S)-2-hydroxy-5-oxo-4-oxatricyclo[4.2.1.0³,⁷]nonane-9-carboxylic acid

Mol formula: C₉H₁₀O₅

Mol weight: 198 Da

Catalog Number(s): BBV-108869022, CSC043445747, FCH9014869

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Properties
SDS

Properties

LogP: -0.86

Heavy atoms count: 14

Rotatable bond count: 1

Number of rings: 3

Carbon bond saturation, Fsp3: 0.777

Polar surface area (Å): 84

Hydrogen bond acceptors count: 4

Hydrogen bond donors count: 2

: Zoom the structure; CSCS00043445747

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