Structure Info
- Chemspace ID
- CSMB00013122376 (Enamine MADE)
- CAS
- 1554796-63-2
- MFCD
- MFCD24322406
- IUPAC Name
- methyl 3-amino-5-chloro-4-fluorobenzoate
- Mol formula
- C8H7ClFNO2
- Mol weight
- 204 Da
- Catalog Number(s)
- 183460, BB4LS-EN300-4396601, BBV-46787634, BI47035, CSC013122376, EMC79663, EN300-4396601, G46702, LN04967272, Y3129971, ZXC387406
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.89
- Heavy atoms count
- 13
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.125
- Polar surface area (Å)
- 52
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00013122376
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