Structure Info
- Chemspace ID
- CSMB00000033638 (Enamine MADE)
- CAS
- 15341-08-9
- MFCD
- MFCD00005825
- IUPAC Name
- (6-nitro-2H-1,3-benzodioxol-5-yl)methanol
- Mol formula
- C8H7NO5
- Mol weight
- 197 Da
- Catalog Number(s)
- 15341-08-9, A159001464, A240085, AA003N8P, AB69989, ACM15341089, AG003NBH, AG193817, AJ69989, AOS003NBH, AR003O0H, AS-85817, ArZ-UP153611, ArZ-UP518504, BBV-94194010, BD6244, CD11248968, CS-0334012, CSC000033638, D762978, F731452, FCH1115834, FN67688, HY-W289045, JH156475, LAN-B37251, LN02141425, LP053914, LQT-B37320, N900783, SAB-103225, W172663, ZX-RC056629, ZXC122734
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.77
- Heavy atoms count
- 14
- Rotatable bond count
- 2
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.25
- Polar surface area (Å)
- 82
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00000033638
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