Structure Info
- Chemspace ID
- CSMB00015945003 (Enamine MADE)
- CAS
- 1862961-45-2
- IUPAC Name
- methyl 3-chloro-5-(methylamino)benzoate
- Mol formula
- C9H10ClNO2
- Mol weight
- 200 Da
- Catalog Number(s)
- BBV-48081306, CSC015945003, CSCR00000494458, EN300-3100049, Z1437061352, s_38_5137482_7022558, s_38____5137482____7022558
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.05
- Heavy atoms count
- 13
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.222
- Polar surface area (Å)
- 38
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00015945003
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