Structure Info
- Chemspace ID
- CSMB00011335467 (Enamine MADE)
- CAS
- 1156202-10-6, 1423027-45-5
- MFCD
- MFCD12123162
- IUPAC Name
- N-(7-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enamide
- Mol formula
- C11H10ClNO3
- Mol weight
- 240 Da
- Catalog Number(s)
- BBV-27170261, CSC011335467, CSCR00005868118, EN300-10200763, FCH15184518, Z2848644106, Z445387494
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.08
- Heavy atoms count
- 16
- Rotatable bond count
- 2
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.181
- Polar surface area (Å)
- 48
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00011335467
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