hexyl isobutyrate (CAS 2349-07-7) — formula C10H20O2, molecular weight 172.15 g/mol; category organic chemicals.
hexyl isobutyrate (CAS 2349-07-7) is a organic chemicals. Its molecular formula C10H20O2 comprises 10 C, 20 H, 2 O atoms. Its molecular weight is about 172.15 g/mol. Reported physicochemical data: boiling point around 198.00 to 199.00 °C. @ 760.00 mm Hg, LogP about 3.5. Organic chemicals are the largest family of carbon-based compounds, widely used across pharmaceuticals, agrochemicals, materials, cosmetics and food industries. Downstream uses span pharmaceutical ingredients, agrochemicals, dyes, solvents, surfactants, food additives and polymer materials. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.
| CAS Number | 2349-07-7 |
|---|---|
| Molecular Formula | C10H20O2 |
| Molecular Weight | 172.15 g/mol |
| Boiling Point | 198.00 to 199.00 °C. @ 760.00 mm Hg |
| LogP | 3.5 |
| Packaging | 25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation) |
| Applications | agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering |
| Category | Organic Chemicals|Flavors |
Documented applications: agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.
hexyl isobutyrate is a carbon-based organic compound with CAS registry number 2349-07-7 and molecular formula C10H20O2 (molecular weight 172.15 g/mol), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2349-07-7
Its molecular formula C10H20O2 comprises 10 C, 20 H, 2 O atoms.
Also known as: hexyl isobutyrate · 异丁酸己酯
Category: organic chemicals / food flavors
The CAS registry number of hexyl isobutyrate is 2349-07-7.
Molecular formula C10H20O2, molecular weight 172.15 g/mol.
It is also registered under: hexyl isobutyrate, 异丁酸己酯.
Recorded applications: agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.
Category: Organic Chemicals / Flavors.
Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.
Independent reference data for hexyl isobutyrate (CAS 2349-07-7), compiled from public chemistry databases.
| 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 |
| 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 |
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
| 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 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.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 异丁酸己酯