butyl valerate (CAS No. 591-68-4) is supplied by Jinan Shenghe Chemical Co., Ltd. with a typical purity of 按批次COA提供(不公开发布). Main applications include Organic Chemicals；Flavors. Bulk quantities are available with COA; purity and packaging are subject to batch COA and order confirmation.
| CAS Number | 591-68-4 |
|---|---|
| Molecular Formula | C9H18O2 |
| Molecular Weight | 158.13 g/mol |
| Melting Point | -92.8 °C |
| Boiling Point | 185.80 °C. @ 760.00 mm Hg |
| LogP | 3.36 |
| Purity | 按批次COA提供(不公开发布) |
| Packaging | 按订单/批次确认(不公开发布) |
| Applications | Organic Chemicals；Flavors |
| Category | Organic Chemicals|Flavors |
Organic Chemicals；Flavors
COA (Certificate of Analysis) is provided with every batch. MSDS/technical data sheets and third-party test reports are available on request. Purity and packaging are subject to batch COA and order confirmation.
The CAS number of butyl valerate is 591-68-4.
Typical purity is 按批次COA提供(不公开发布), supplied in 按订单/批次确认(不公开发布), with COA provided.
Main applications include Organic Chemicals；Flavors.
Email info@591daili.com or reach us on WhatsApp with the product name, CAS number and required quantity; quotes within one business day. Supplier: Jinan Shenghe Chemical Co., Ltd..
butyl valerate is identified by CAS 591-68-4, molecular formula C9H18O2 and molecular weight 158.13 g/mol. UNII F93Z6CCM06; ChEBI 89761; InChIKey OKJADYKTJJGKDX-UHFFFAOYSA-N. Boiling Point: 185.80 °C. @ 760.00 mm Hg; Boiling Point: 186.5 °C; Melting Point: -92.8 °C.
| CAS Registry Number | 591-68-4 |
|---|---|
| PubChem CID | 61137 |
| Molecular formula | C9H18O2 |
| Molecular weight | 158.13 g/mol |
| IUPAC name | butyl pentanoate |
| InChIKey | OKJADYKTJJGKDX-UHFFFAOYSA-N |
| UNII (FDA) | F93Z6CCM06 |
| ChEBI ID | CHEBI:89761 |
| FEMA number | 2217 |
| JECFA number | 160 |
| Molecular Weight | 158.24 |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 7 |
| Exact Mass | 158.130679813 |
| Monoisotopic Mass | 158.130679813 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Boiling Point | 185.80 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 186.5 °C |
| Melting Point | -92.8 °C |
| Density | 0.861-0.871(d20/4) |
| LogP | 3.36 |
| Refractive Index | 1.408-1.416 |
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fruity No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 6.3% (89 / 1417) |
| GHS notification summary | 6.3% (89 / 1417) |
|---|---|
| Reported hazard statements | H226 (90.8%) |
This chemical does not meet GHS hazard criteria for 6.3% (89 of 1417) of reports.
H226 (90.8%): Flammable liquid and vapor [Warning Flammable liquids]
Butyl valerate; Butyl pentanoate; PENTANOIC ACID, BUTYL ESTER; FEMA No. 2217; F93Z6CCM06; UNII-F93Z6CCM06; EINECS 209-728-5; BUTYL VALERATE [FHFI]; AI3-30051; BUTYL VALERATE [USP-RS]; DTXSID3060455; FEMA 2217; BUTYL VALERATE (USP-RS); Butyl pentanoic acid; RefChem:122295; DTXCID4042547
CAS 591-68-4; molecular formula C9H18O2; molecular weight 158.13 g/mol.
Butyl valerate, Butyl pentanoate, PENTANOIC ACID, BUTYL ESTER, FEMA No. 2217, F93Z6CCM06, UNII-F93Z6CCM06.
Documented regulatory listings: EU Flavoring substances; FDA Substance added to food: FLAVORING AGENT OR ADJUVANT; Flavoring Agents.
6.3% of GHS notifications report no hazard classification (89 of 1417).
Boiling Point: 185.80 °C. @ 760.00 mm Hg; Boiling Point: 186.5 °C; Melting Point: -92.8 °C; Density: 0.861-0.871(d20/4).
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.
Supplier: Jinan Shenghe Chemical Co., Ltd.
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