4'-Chlorovalerophenone (CAS 25017-08-7) — formula C11H13ClO, molecular weight 196.67; category organic chemicals.
4'-Chlorovalerophenone is a carbon-based organic compound with CAS registry number 25017-08-7 and molecular formula C11H13ClO (molecular weight 196.67), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 25017-08-7
Its molecular formula C11H13ClO comprises 11 C, 13 H, 1 Cl, 1 O atoms.
Also known as: 4'-Chlorovalerophenone · p-Chlorovalerophenone
Category: organic chemicals
The CAS registry number of 4'-Chlorovalerophenone is 25017-08-7.
Molecular formula C11H13ClO, molecular weight 196.67.
It is also registered under: 4'-Chlorovalerophenone, p-Chlorovalerophenone.
Category: Organic Chemicals.
Public-database records for 4'-Chlorovalerophenone (CAS 25017-08-7), reproduced here for independent cross-checking.
| Reported hazard statements | H302 (90.7%), H317 (90.7%) |
|---|
H302 (90.7%): Harmful if swallowed [Warning Acute toxicity, oral]
H317 (90.7%): May cause an allergic skin reaction [Warning Sensitization, Skin]
| CAS Registry Number | 25017-08-7 |
|---|---|
| PubChem CID | 90686 |
| 分子式 | C11H13ClO |
| IUPAC 名称 | 1-(4-chlorophenyl)pentan-1-one |
| UNII（FDA） | S62TTW9MS5 |
4'-Chlorovalerophenone; p-CHLOROVALEROPHENONE; S62TTW9MS5; EINECS 246-566-4; NSC-76591; DTXSID70179717; NSC 76591; RefChem:506076; DTXCID30102208; 246-566-4; 1-(4-chlorophenyl)pentan-1-one; 25017-08-7; 1-Pentanone, 1-(4-chlorophenyl)-; MFCD00018716; 4'-Chloropentanophenone; 1-(4-Chlorophenyl)-1-pentanone
| 分子量 | 196.67 |
|---|---|
| XLogP3 | 3.6 |
| 氢键供体数 | 0 |
| 氢键受体数 | 1 |
| 可旋转键数 | 4 |
| 精确质量 | 196.0654927 |
| 单同位素质量 | 196.0654927 |
| 拓扑极性表面积 | 17.1 |
| 重原子数 | 13 |
| 形式电荷 | 0 |
4'-Chlorovalerophenone · CAS 25017-08-7 · C11H13ClO. UNII S62TTW9MS5.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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