Structure Info
- Chemspace ID
- CSSS00009841914 (In-Stock Screening Compounds)
- CAS
- 1261868-02-3
- MFCD
- MFCD18410963
- IUPAC Name
- 2-chloro-4-ethylbenzoic acid
- Mol formula
- C9H9ClO2
- Mol weight
- 185 Da
- Catalog Number(s)
- A010000087, ArZ-UP359959, BB4LS-EN300-7831991, BBV-39713558, BI37211, CSC009841914, EN300-7831991, FCH1135912, Y3128647, Z1255359653, ZX-NM262609, ZXC387144
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.19
- Heavy atoms count
- 12
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.222
- Polar surface area (Å)
- 37
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS00009841914
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