Structure Info
- Chemspace ID
- CSSS00010069829 (In-Stock Screening Compounds)
- CAS
- 1205750-91-9
- MFCD
- MFCD12406279
- IUPAC Name
- 3,3-dimethyl-2,3-dihydro-1H-indole-5-carboxylic acid hydrochloride
- Mol formula
- C11H14ClNO2
- Mol weight
- 228 Da
- Catalog Number(s)
- BB4LS-EN300-9597878, BBV-49316598, BL35984, CSC010069829, EN300-9597878, Y3144479, Z1617983906, ZX-NM254496, ZXC292724
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.74
- Heavy atoms count
- 15
- Rotatable bond count
- 1
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.363
- Polar surface area (Å)
- 49
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSSS00010069829
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