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4-Chlorophenylacetone · CAS 5586-88-9 · C9H9ClO. UNII I2FE1ERE85.
| CAS Registry Number | 5586-88-9 |
|---|---|
| PubChem CID | 79699 |
| Molecular formula | C9H9ClO |
| IUPAC name | 1-(4-chlorophenyl)propan-2-one |
| UNII (FDA) | I2FE1ERE85 |
| Molecular Weight | 168.62 |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| Exact Mass | 168.0341926 |
| Monoisotopic Mass | 168.0341926 |
| Topological Polar Surface Area | 17.1 |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Reported hazard statements | H302 (75%), H312 (50%), H315 (75%), H319 (75%), H332 (50%), H335 (75%), H412 (25%) |
|---|
H302 (75%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]
5586-88-9; 1-(4-chlorophenyl)propan-2-one; 1-(4-Chlorophenyl)acetone; 1-(p-Chlorophenyl)acetone; 2-Propanone, 1-(4-chlorophenyl)-; 1-(4-Chlorophenyl)-2-propanone; p-(Chlorophenyl)acetone; Methyl p-chlorobenzyl ketone; 4-chlorobenzyl methyl ketone; I2FE1ERE85; NSC 22985; (p-chlorophenyl)acetone; (4-chlorophenyl)acetone; EINECS 226-986-4; NSC-22985; UNII-I2FE1ERE85
CAS 5586-88-9; molecular formula C9H9ClO; molecular weight — g/mol.
5586-88-9, 1-(4-chlorophenyl)propan-2-one, 1-(4-Chlorophenyl)acetone, 1-(p-Chlorophenyl)acetone, 2-Propanone, 1-(4-chlorophenyl)-, 1-(4-Chlorophenyl)-2-propanone.
Hazard statements reported: H302, H312, H315, H319, H332.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.