1-(6-Chloro-2-naphthyl)ethanone
Basic information
- CAS
42036-59-9- Standard SMILES
CC(=O)c1ccc2cc(Cl)ccc2c1- InChIKey
HCZZBHVHIMDUSH-UHFFFAOYSA-N- Molecular formula
- C12H9ClO
- Average molar mass
- 204.65 g/mol
- Monoisotopic mass
- 204.0341926
Names & identifiers
- Preferred name
- 1-(6-Chloro-2-naphthyl)ethanone
- IUPAC
- 1-(6-chloronaphthalen-2-yl)ethanone
- English name
- 1-(6-Chloro-naphthalen-2-yl)-ethanone
- Molecular formula
- C12H9ClO
- Molecular weight
- 204.65
Names & synonyms
1-(6-Chloro-2-naphthyl)ethanone42036-59-91-(6-Chloronaphthalen-2-yl)ethan-1-one1-(6-chloronaphthalen-2-yl)ethanoneNSC1520206-Chloro-2-acetonaphthoneSCHEMBL11662765DTXSID00302596HCZZBHVHIMDUSH-UHFFFAOYSA-N1-(6-Chloro-2-naphthyl)ethanone #NSC-152020DS-020412
Show more names
1-(6-Chloro-2-naphthalenyl)ethanone1-(6-Chloro-naphthalen-2-yl)-ethanoneEthanone, 1-(6-chloro-2-naphthalenyl)-
Database identifiers
- CAS
42036-59-9- PubChem CID
- 289770
- DTXSID
DTXSID00302596- Nikkaji
- J274.467H
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 226
Physicochemical properties
- Melting point
- 83.5 · 83.5-84 °C
- Boiling point
- 225 · 225-227 °C(Press: 4.2 Torr)
- Density
- 1.225 · 1.225±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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