Vanillin acetate(CAS 881-68-5):分子式 C10H10O4、分子量 194.06 g/mol。
Vanillin acetate 是一种化工化合物,登记 CAS 号为 881-68-5,分子式 C10H10O4(分子量 194.06 g/mol)。
登记 CAS 号:881-68-5
其分子式 C10H10O4 由 10 个碳、10 个氢、4 个氧 组成。
别名/同义词:Vanillin acetate · acetyl vanillin
Vanillin acetate 的 CAS 登记号为 881-68-5。
分子式 C10H10O4,分子量 194.06 g/mol。
别名/同义词:Vanillin acetate、acetyl vanillin。
Vanillin acetate(CAS 881-68-5)的公开数据库记录,列此仅供独立核对。
| GHS notification summary | 60.4% (90 / 149) |
|---|---|
| Reported hazard statements | H315 (39.6%), H319 (39.6%) |
This chemical does not meet GHS hazard criteria for 60.4% (90 of 149) of all reports.
H315 (39.6%): Causes skin irritation [Warning Skin corrosion/irritation]
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Floral No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 60.4% (90 / 149) |
| 沸点 | 287.00 to 288.00 °C. @ 760.00 mm Hg |
|---|---|
| 沸点 | 148 °C (10 mm Hg) |
| 熔点 | 77 - 79 °C |
| CAS Registry Number | 881-68-5 |
|---|---|
| PubChem CID | 61229 |
| 分子式 | C10H10O4 |
| 分子量 | 194.06 g/mol |
| IUPAC 名称 | (4-formyl-2-methoxyphenyl) acetate |
| InChIKey | PZSJOBKRSVRODF-UHFFFAOYSA-N |
| UNII(FDA) | 873YNA60FY |
| ChEBI 编号 | CHEBI:86956 |
| FEMA 编号 | 3108 |
| JECFA 编号 | 890 |
Vanillin acetate; 4-Formyl-2-methoxyphenyl acetate; Acetylvanillin; Acetovanillin; BENZALDEHYDE, 4-(ACETYLOXY)-3-METHOXY-; vanillyl acetate; FEMA No. 3108; UNII-873YNA60FY; 873YNA60FY; Benzaldehyde, 4-acetoxy-3-methoxy; NSC-8499; EINECS 212-920-1; NSC-25863; VANILLIN ACETATE [FHFI]; DTXSID4061256; CHEBI:86956
| 分子量 | 194.18 |
|---|---|
| XLogP3 | 0.8 |
| 氢键供体数 | 0 |
| 氢键受体数 | 4 |
| 可旋转键数 | 4 |
| 精确质量 | 194.05790880 |
| 单同位素质量 | 194.05790880 |
| 拓扑极性表面积 | 52.6 |
| 重原子数 | 14 |
| 形式电荷 | 0 |
Vanillin acetate is identified by CAS 881-68-5, molecular formula C10H10O4 and molecular weight 194.06 g/mol. UNII 873YNA60FY; ChEBI 86956; InChIKey PZSJOBKRSVRODF-UHFFFAOYSA-N. 沸点: 287.00 to 288.00 °C. @ 760.00 mm Hg; 沸点: 148 °C (10 mm Hg); 熔点: 77 - 79 °C.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。