2,4,4-TRIMETHYLCYCLOPENTANONE (CAS 4694-12-6) — formula C8H14O, molecular weight 126.20; category organic chemicals.
Documented applications: General Manufacturing Information: Cyclopentanone, 2, 4, 4-trimethyl-: ACTIVE.
2,4,4-TRIMETHYLCYCLOPENTANONE is a carbon-based organic compound with CAS registry number 4694-12-6 and molecular formula C8H14O (molecular weight 126.20), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 4694-12-6
Its molecular formula C8H14O comprises 8 C, 14 H, 1 O atoms.
Also known as: 2,4,4-TRIMETHYLCYCLOPENTANONE · 2,4,4-三甲基环戊酮
Category: organic chemicals
The CAS registry number of 2,4,4-TRIMETHYLCYCLOPENTANONE is 4694-12-6.
Molecular formula C8H14O, molecular weight 126.20.
It is also registered under: 2,4,4-TRIMETHYLCYCLOPENTANONE, 2,4,4-三甲基环戊酮.
Recorded applications: General Manufacturing Information: Cyclopentanone, 2, 4, 4-trimethyl-: ACTIVE.
Category: Organic Chemicals.
Public-database records for 2,4,4-TRIMETHYLCYCLOPENTANONE (CAS 4694-12-6), reproduced here for independent cross-checking.
| 已通报的危害声明 | H226 (100%) |
|---|
| CAS 号 | 4694-12-6 |
|---|---|
| PubChem CID | 107324 |
| 分子式 | C8H14O |
| IUPAC 名称 | 2,4,4-trimethylcyclopentan-1-one |
| UNII（FDA） | IRJ0Q2WNHK |
2,4,4-Trimethylcyclopentanone; 4694-12-6; 2,4,4-Trimethylcyclopentan-1-one; Cyclopentanone, 2,4,4-trimethyl-; IRJ0Q2WNHK; arylsulfonamide 11c; UNII-IRJ0Q2WNHK; DTXSID40871094; EINECS 225-155-3; RefChem:81984; DTXCID80818766; (+-)-2,4,4-TRIMETHYLCYCLOPENTANONE; 2,4,4-TRIMETHYLCYCLOPENTANONE, (+-)-; OXTQEWUBDTVSFB-UHFFFAOYSA-N; MFCD00019313; SCHEMBL108518
| 分子量 | 126.20 |
|---|---|
| XLogP3 | 1.8 |
| 氢键供体数 | 0 |
| 氢键受体数 | 1 |
| 可旋转键数 | 0 |
| 精确质量 | 126.104465066 |
| 单同位素质量 | 126.104465066 |
| 拓扑极性表面积 | 17.1 |
| 重原子数 | 9 |
| 形式电荷 | 0 |
2,4,4-三甲基环戊酮 · CAS 4694-12-6 · C8H14O. UNII IRJ0Q2WNHK.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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