Structure Info
- Chemspace ID
- CSMB00016607171 (Enamine MADE)
- IUPAC Name
- prop-2-yn-1-yl 4-amino-3,5-dichlorobenzoate
- Mol formula
- C10H7Cl2NO2
- Mol weight
- 244 Da
- Catalog Number(s)
- BBV-48431522, CSC016607171, CSCR00003163986, FCH3320555, Z1537577805, s_1458_7917782_484372, s_1458____7917782____484372
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.58
- Heavy atoms count
- 15
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.1
- Polar surface area (Å)
- 52
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00016607171
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