2-Chloro-2-phenylpropanal
Basic information
- CAS
6124-66-9- Standard SMILES
CC(Cl)(C=O)c1ccccc1- InChIKey
GUXSRVZDSMGGJX-UHFFFAOYSA-N- Molecular formula
- C9H9ClO
- Average molar mass
- 168.62 g/mol
- Monoisotopic mass
- 168.0341926
Names & identifiers
- Preferred name
- 2-Chloro-2-phenylpropanal
- IUPAC
- 2-chloro-2-phenylpropanal
Names & synonyms
2-chloro-2-phenylpropanal6124-66-9NSC601841SCHEMBL15259639SCHEMBL273171342-chloro-2-phenyl-propionaldehydeNSC-601841EN300-175824G59995
Database identifiers
- CAS
6124-66-9- PubChem CID
- 353469
- EC Number
- 181-878-3
- Nikkaji
- J665.961F
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 140
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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