异丁酸己酯，CAS 登记号 2349-07-7，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 异丁酸己酯 的 CAS 号：2349-07-7，可与随货 COA 核对。
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hexyl isobutyrate is identified by CAS 2349-07-7, molecular formula C10H20O2 and molecular weight 172.15 g/mol. UNII 5FC79GHU69; ChEBI 179553; InChIKey CYHBDKTZDLSRMY-UHFFFAOYSA-N. Boiling Point: 198.00 to 199.00 °C. @ 760.00 mm Hg; Boiling Point: 199 °C; Density: 0.852-0.876.
| CAS Registry Number | 2349-07-7 |
|---|---|
| PubChem CID | 16872 |
| Molecular formula | C10H20O2 |
| Molecular weight | 172.15 g/mol |
| IUPAC name | hexyl 2-methylpropanoate |
| InChIKey | CYHBDKTZDLSRMY-UHFFFAOYSA-N |
| UNII (FDA) | 5FC79GHU69 |
| ChEBI ID | CHEBI:179553 |
| FEMA number | 3172 |
| JECFA number | 189 |
| Molecular Weight | 172.26 |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 7 |
| Exact Mass | 172.146329876 |
| Monoisotopic Mass | 172.146329876 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Boiling Point | 198.00 to 199.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 199 °C |
| Density | 0.852-0.876 |
| Refractive Index | 1.399-1.421 |
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fruit No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 99.1% (1615 / 1629) |
| GHS notification summary | 99.1% (1615 / 1629) |
|---|
This chemical does not meet GHS hazard criteria for 99.1% (1615 of 1629) of all reports.
Reported as not meeting GHS hazard criteria by 1615 of 1629 companies (only 0.9% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
Hexyl isobutyrate; 2349-07-7; HEXYL 2-METHYLPROPANOATE; Propanoic acid, 2-methyl-, hexyl ester; Hexyl isobutanoate; n-Hexyl isobutyrate; 1-Hexyl isobutyrate; Isobutyric acid, hexyl ester; n-Hexyl isobutanoate; Hexyl 2-methylpropionate; FEMA No. 3172; DTXSID2047519; Hexyl isobutyrate (natural); NSC 46108; 5FC79GHU69; EINECS 219-075-8
CAS 2349-07-7; molecular formula C10H20O2; molecular weight 172.15 g/mol.
Hexyl isobutyrate, 2349-07-7, HEXYL 2-METHYLPROPANOATE, Propanoic acid, 2-methyl-, hexyl ester, Hexyl isobutanoate, n-Hexyl isobutyrate.
Documented regulatory listings: EU Flavoring substances; FDA Substance added to food: FLAVORING AGENT OR ADJUVANT; Flavoring Agents.
99.1% of GHS notifications report no hazard classification (1615 of 1629).
Boiling Point: 198.00 to 199.00 °C. @ 760.00 mm Hg; Boiling Point: 199 °C; Density: 0.852-0.876; Refractive Index: 1.399-1.421.
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.