≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 528768904 |
|---|---|
| 정식 스마일 | CCCCC1CCCCC(=O)O1 |
| IUPAC Name | 7-butyloxepan-2-one |
| InChIKey | YKVIWISPFDZYOW-UHFFFAOYSA-N |
| INCHI | 1S/C10H18O2/c1-2-3-6-9-7-4-5-8-10(11)12-9/h9H,2-8H2,1H3 |
| 이성체 SMILES | CCCCC1CCCCC(=O)O1 |
| 분자량 | 170.25 |
| Reaxy-Rn | 117541 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=117541&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| 분류 | Lactones |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Lactones |
| Alternative Parents | Oxepanes Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | Caprolactone - Oxepane - Lactone - Carboxylic acid ester - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic heteromonocyclic compound |
| 설명 | This compound belongs to the class of organic compounds known as lactones. These are cyclic esters of hydroxy carboxylic acids, containing a 1-oxacycloalkan-2-one structure, or analogues having unsaturation or heteroatoms replacing one or more carbon atoms of the ring. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | 날짜 | 항목 |
|---|---|---|---|
 D2602320 | Certificate of Analysis | Mar 18, 2026 | D465508 |
| D2602321 | Certificate of Analysis | Mar 18, 2026 | D465508 |
| D2602323 | Certificate of Analysis | Mar 18, 2026 | D465508 |
| K2504302 | Certificate of Analysis | Oct 21, 2025 | D465508 |
| K2504303 | Certificate of Analysis | Oct 21, 2025 | D465508 |
| K2504308 | Certificate of Analysis | Oct 21, 2025 | D465508 |
| K2504309 | Certificate of Analysis | Oct 21, 2025 | D465508 |
| C2512409 | Certificate of Analysis | Oct 14, 2024 | D465508 |
| C2512412 | Certificate of Analysis | Oct 14, 2024 | D465508 |
| C2512559 | Certificate of Analysis | Oct 14, 2024 | D465508 |
| C2512561 | Certificate of Analysis | Oct 14, 2024 | D465508 |
| C2512562 | Certificate of Analysis | Oct 14, 2024 | D465508 |
| C2512565 | Certificate of Analysis | Oct 14, 2024 | D465508 |
| C2512566 | Certificate of Analysis | Oct 14, 2024 | D465508 |
| J2424556 | Certificate of Analysis | Oct 14, 2024 | D465508 |
| J2424558 | Certificate of Analysis | Oct 14, 2024 | D465508 |
| 굴절률 | n20/D 1.461 (lit.) |
|---|---|
| 발화점(°F) | 235.4 °F - closed cup |
| 발화점(°C) | 113 °C - closed cup |
| 끓는점(°C) | 117℃/3mmHg (lit.) |
| 분자량 | 170.250 g/mol |
| XLogP3 | 2.800 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 170.131 Da |
| Monoisotopic Mass | 170.131 Da |
| Topological Polar Surface Area | 26.300 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 143.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
