Pentyl valerate (CAS 2173-56-0) — formula C10H20O2, molecular weight 172.15 g/mol.
Pentyl valerate is a chemical compound with CAS registry number 2173-56-0 and molecular formula C10H20O2 (molecular weight 172.15 g/mol).
CAS number: 2173-56-0
Its molecular formula C10H20O2 comprises 10 C, 20 H, 2 O atoms.
Also known as: Pentyl valerate · amyl valerate · N-AMYL VALERATE
The CAS registry number of Pentyl valerate is 2173-56-0.
Molecular formula C10H20O2, molecular weight 172.15 g/mol.
It is also registered under: Pentyl valerate, amyl valerate, N-AMYL VALERATE.
Public-database records for Pentyl valerate (CAS 2173-56-0), reproduced here for independent cross-checking.
| GHS notification summary | 90.7% (245 / 270) |
|---|
This chemical does not meet GHS hazard criteria for 90.7% (245 of 270) of all reports.
Reported as not meeting GHS hazard criteria by 245 of 270 companies (only 9.3% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
| Regulatory & Food Contact | EU Flavoring substances Flavoring Agents |
|---|---|
| GHS notification summary | 90.7% (245 / 270) |
| CAS Registry Number | 2173-56-0 |
|---|---|
| PubChem CID | 62433 |
| 分子式 | C10H20O2 |
| 分子量 | 172.15 g/mol |
| IUPAC 名称 | pentyl pentanoate |
| InChIKey | FGPPDYNPZTUNIU-UHFFFAOYSA-N |
| UNII（FDA） | 694D4BU139 |
Pentyl valerate; Pentyl pentanoate; 2173-56-0; Amyl valerate; Valeric Acid Pentyl Ester; DTXSID8042218; N-Amyl N-valerate; EINECS 218-528-7; NSC-76414; 694D4BU139; BRN 1754427; Pentyl ester of pentanoic acid; AI3-01269; DTXCID6022218; UNII-694D4BU139; 4-02-00-00872 (Beilstein Handbook Reference)
| 分子量 | 172.26 |
|---|---|
| XLogP3 | 3.3 |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 8 |
| 精确质量 | 172.146329876 |
| 单同位素质量 | 172.146329876 |
| 拓扑极性表面积 | 26.3 |
| 重原子数 | 12 |
| 形式电荷 | 0 |
Pentyl valerate is identified by CAS 2173-56-0, molecular formula C10H20O2 and molecular weight 172.15 g/mol. UNII 694D4BU139; InChIKey FGPPDYNPZTUNIU-UHFFFAOYSA-N.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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