异戊基苯乙酸酯/苯乙酸异戊酯，CAS 登记号 102-19-2，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。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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Isoamyl phenylacetate is identified by CAS 102-19-2, molecular formula C13H18O2 and molecular weight 206.13 g/mol. UNII E5RHQ50DDC; ChEBI 191542; InChIKey QWBQBUWZZBUFHN-UHFFFAOYSA-N. Boiling Point: 268.00 °C. @ 760.00 mm Hg; Boiling Point: 268 °C; Density: 0.975-0.981.
| CAS Registry Number | 102-19-2 |
|---|---|
| PubChem CID | 7600 |
| Molecular formula | C13H18O2 |
| Molecular weight | 206.13 g/mol |
| IUPAC name | 3-methylbutyl 2-phenylacetate |
| InChIKey | QWBQBUWZZBUFHN-UHFFFAOYSA-N |
| UNII (FDA) | E5RHQ50DDC |
| ChEBI ID | CHEBI:191542 |
| FEMA number | 2081 |
| JECFA number | 1014 |
| Molecular Weight | 206.28 |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 6 |
| Exact Mass | 206.130679813 |
| Monoisotopic Mass | 206.130679813 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Boiling Point | 268.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 268 °C |
| Density | 0.975-0.981 |
| LogP | 3.870 |
| Refractive Index | 1.483-1.490 |
| 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 | 97.1% (1598 / 1646) |
| GHS notification summary | 97.1% (1598 / 1646) |
|---|
This chemical does not meet GHS hazard criteria for 97.1% (1598 of 1646) of all reports.
Reported as not meeting GHS hazard criteria by 1598 of 1646 companies (only 2.9% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
Isoamyl phenylacetate; 102-19-2; Isopentyl phenylacetate; Benzeneacetic acid, 3-methylbutyl ester; 3-Methylbutyl phenylacetate; 3-methylbutyl 2-phenylacetate; Isoamyl alpha-toluate; FEMA No. 2081; isoamyl phenyl acetate; NSC 60582; UNII-E5RHQ50DDC; E5RHQ50DDC; EINECS 203-012-6; BRN 1951778; iso-Amyl phenylacetate; AI3-36555
CAS 102-19-2; molecular formula C13H18O2; molecular weight 206.13 g/mol.
Isoamyl phenylacetate, 102-19-2, Isopentyl phenylacetate, Benzeneacetic acid, 3-methylbutyl ester, 3-Methylbutyl phenylacetate, 3-methylbutyl 2-phenylacetate.
Documented regulatory listings: EU Flavoring substances; FDA Substance added to food: FLAVORING AGENT OR ADJUVANT; Flavoring Agents.
97.1% of GHS notifications report no hazard classification (1598 of 1646).
Boiling Point: 268.00 °C. @ 760.00 mm Hg; Boiling Point: 268 °C; Density: 0.975-0.981; LogP: 3.870.
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.