Structure Info
- Chemspace ID
- CSMB00010439447 (Enamine MADE)
- CAS
- 871333-98-1
- MFCD
- MFCD14279382, MFCD07783853
- IUPAC Name
- {bicyclo[2.2.1]hept-2-en-2-yl}boronic acid
- Mol formula
- C7H11BO2
- Mol weight
- 138 Da
- Catalog Number(s)
- A249000305, A674085, AA003O3W, AB71112, AG003O6O, AG121420, ArZ-UP088674, ArZ-UP387922, B382873, BBV-45244066, BD3831, BS-23484, CD13002887, CM137107, CS-0088544, CSC010439447, EN300-7396564, FCH1806035, LN02142326, OR9349, P45018, PBEB10427, PW1172, SY044945, X0606, Y1191476, ZX-AE028375, ZXC161058, pw1172
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.72
- Heavy atoms count
- 10
- Rotatable bond count
- 1
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.714
- Polar surface area (Å)
- 40
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSMB00010439447
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