2-Isopropyl-N,2,3-trimethylbutyramide (CAS 51115-67-4) — formula C10H21NO, molecular weight 171.16 g/mol.
2-Isopropyl-N,2,3-trimethylbutyramide is a chemical compound with CAS registry number 51115-67-4 and molecular formula C10H21NO (molecular weight 171.16 g/mol).
CAS number: 51115-67-4
Its molecular formula C10H21NO comprises 10 C, 21 H, 1 N, 1 O atoms.
Also known as: 2-Isopropyl-N,2,3-trimethylbutyramide · WS-23 · N,2,3-Trimethyl-2-isopropylbutamide
The CAS registry number of 2-Isopropyl-N,2,3-trimethylbutyramide is 51115-67-4.
Molecular formula C10H21NO, molecular weight 171.16 g/mol.
It is also registered under: 2-Isopropyl-N,2,3-trimethylbutyramide, WS-23, N,2,3-Trimethyl-2-isopropylbutamide.
Public-database records for 2-Isopropyl-N,2,3-trimethylbutyramide (CAS 51115-67-4), reproduced here for independent cross-checking.
| GHS 通报统计 | 2.5% (36 / 1455) |
|---|---|
| 已通报的危害声明 | H302 (97.5%) |
| 法规与食品接触 | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Mint, Cool ACCEPTABLE (CONDITIONAL) |
|---|---|
| GHS 通报统计 | 2.5% (36 / 1455) |
| 沸点 | 233.00 to 234.00 °C. @ 760.00 mm Hg |
|---|---|
| 熔点 | 56 - 64 °C |
| CAS 号 | 51115-67-4 |
|---|---|
| PubChem CID | 65300 |
| 分子式 | C10H21NO |
| 分子量 | 171.16 g/mol |
| IUPAC 名称 | N,2,3-trimethyl-2-propan-2-ylbutanamide |
| InChIKey | RWAXQWRDVUOOGG-UHFFFAOYSA-N |
| UNII（FDA） | 6QOP5A9489 |
| ChEBI 编号 | CHEBI:169004 |
| FEMA 编号 | 3804 |
| JECFA 编号 | 1595 |
51115-67-4; 2-Isopropyl-N,2,3-trimethylbutanamide; 2-Isopropyl-N,2,3-trimethylbutyramide; Methyl diisopropyl propionamide; N,2,3-trimethyl-2-propan-2-ylbutanamide; WS-23; N,2,3-Trimethyl-2-isopropylbutanamide; N,2,3-Trimethyl-2-(1-methylethyl)butanamide; Trimethyl isopropyl butanamide; Butanamide, N,2,3-trimethyl-2-(1-methylethyl)-; N,2,3-trimethyl-2-(propan-2-yl)butanamide; FEMA NO. 3804; 6QOP5A9489; WS 23; EINECS 256-974-4; DTXSID40199124
| 分子量 | 171.28 |
|---|---|
| XLogP3 | 2.5 |
| 氢键供体数 | 1 |
| 氢键受体数 | 1 |
| 可旋转键数 | 3 |
| 精确质量 | 171.162314293 |
| 单同位素质量 | 171.162314293 |
| 拓扑极性表面积 | 29.1 |
| 重原子数 | 12 |
| 形式电荷 | 0 |
N,2,3-三甲基-2-异丙基丁酰胺(WS-23) 的 CAS 号为 51115-67-4，分子式 C10H21NO，分子量 171.16 g/mol。 UNII 6QOP5A9489; ChEBI 169004; InChIKey RWAXQWRDVUOOGG-UHFFFAOYSA-N. 沸点: 233.00 to 234.00 °C. @ 760.00 mm Hg; 熔点: 56 - 64 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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