Basic information
- CAS
6955-65-3- Standard SMILES
Nc1cc2c(cc1Cl)-c1ccccc1C2=O- InChIKey
YLGCVVKUIBTNFX-UHFFFAOYSA-N- Molecular formula
- C13H8ClNO
- Average molar mass
- 229.66 g/mol
- Monoisotopic mass
- 229.0294416
Names & identifiers
- Preferred name
- 2-Amino-3-chloro-9h-fluoren-9-one
- IUPAC
- 2-amino-3-chlorofluoren-9-one
- English name
- 2-amino-3-chloro-fluoren-9-one
- Molecular formula
- C13H8ClNO
- Molecular weight
- 229.66
Names & synonyms
6955-65-32-amino-3-chloro-9h-fluoren-9-oneNSC67677NCIOpen2_003455NCIOpen2_008384DTXSID90989532NSC-676773-amino-3-chloro-9-fluorenone2-amino-3-chloro-fluoren-9-one9H-Fluoren-9-one, 2-amino-3-chloro-
Database identifiers
- CAS
6955-65-3- PubChem CID
- 249387
- DTXSID
DTXSID90989532- Nikkaji
- J308.085D
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 306
Physicochemical properties
- Melting point
- 189 °C · 189 °C
- Boiling point
- 447.8 · 447.8±38.0 °C(Predicted)
- Density
- 1.443 · 1.443±0.06 g/cm3(Predicted)
- pka
- 1.11 · 1.11±0.20(Predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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