对叔丁基苯乙酸甲酯，CAS 登记号 3549-23-3，由济南圣和化工有限公司现货供应，可提供纯度 按批次COA提供(不公开发布) 的规格，下游主要用于食用香精；有机化学品。支持样品与小批量试用，批量价格请联系我们获取，验收以批次 COA 为准。
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本页已列出 对叔丁基苯乙酸甲酯 的 CAS 号：3549-23-3，可与随货 COA 核对。
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Methyl p-tert-butylphenylacetate is identified by CAS 3549-23-3, molecular formula C13H18O2 and molecular weight 206.13 g/mol. UNII 8A4H5QO9OJ; InChIKey HXVTYMWVMVKVTF-UHFFFAOYSA-N. Boiling Point: 106.00 to 107.00 °C. @ 2.00 mm Hg; Boiling Point: 106 °C (2 mm Hg); 93 °C (1 mm Hg); Density: 0.995-1.003.
| CAS Registry Number | 3549-23-3 |
|---|---|
| PubChem CID | 605629 |
| Molecular formula | C13H18O2 |
| Molecular weight | 206.13 g/mol |
| IUPAC name | methyl 2-(4-tert-butylphenyl)acetate |
| InChIKey | HXVTYMWVMVKVTF-UHFFFAOYSA-N |
| UNII (FDA) | 8A4H5QO9OJ |
| FEMA number | 2690 |
| JECFA number | 1025 |
| Molecular Weight | 206.28 |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 206.130679813 |
| Monoisotopic Mass | 206.130679813 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Boiling Point | 106.00 to 107.00 °C. @ 2.00 mm Hg |
|---|---|
| Boiling Point | 106 °C (2 mm Hg); 93 °C (1 mm Hg) |
| Density | 0.995-1.003 |
| Refractive Index | 1.494-1.504 |
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: 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 | 98.9% (91 / 92) |
| GHS notification summary | 98.9% (91 / 92) |
|---|
This chemical does not meet GHS hazard criteria for 98.9% (91 of 92) of all reports.
Reported as not meeting GHS hazard criteria by 91 of 92 companies (only 1.1% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
3549-23-3; Methyl p-tert-butylphenylacetate; Methyl 4-tert-butylphenylacetate; methyl 2-(4-tert-butylphenyl)acetate; Benzeneacetic acid, 4-(1,1-dimethylethyl)-, methyl ester; FEMA No. 2690; 8A4H5QO9OJ; Acetic acid, (p-tert-butylphenyl)-, methyl ester; DTXSID0063070; Methyl 4-(1,1-dimethylethyl)benzeneacetate; EINECS 222-602-4; METHYL 4-TERT-BUTYLBENZENEACETATE; METHYL P-TERT-BUTYLPHENYLACETATE [FHFI]; (4-TERT-BUTYLPHENYL)ACETIC ACID METHYL ESTER; RefChem:818012; DTXCID8039033
CAS 3549-23-3; molecular formula C13H18O2; molecular weight 206.13 g/mol.
3549-23-3, Methyl p-tert-butylphenylacetate, Methyl 4-tert-butylphenylacetate, methyl 2-(4-tert-butylphenyl)acetate, Benzeneacetic acid, 4-(1,1-dimethylethyl)-, methyl ester, FEMA No. 2690.
Documented regulatory listings: EU Flavoring substances; FDA Substance added to food: FLAVORING AGENT OR ADJUVANT; Flavoring Agents.
98.9% of GHS notifications report no hazard classification (91 of 92).
Boiling Point: 106.00 to 107.00 °C. @ 2.00 mm Hg; Boiling Point: 106 °C (2 mm Hg); 93 °C (1 mm Hg); Density: 0.995-1.003; Refractive Index: 1.494-1.504.
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.