2-Pentyl acetate (CAS 626-38-0) — formula C7H14O2, molecular weight 130.10 g/mol.
Documented applications: Used as a solvent for ethyl cellulose, nitrocellulose, printing inks, also used in the production of coatings and cements.
2-Pentyl acetate is a chemical compound with CAS registry number 626-38-0 and molecular formula C7H14O2 (molecular weight 130.10 g/mol).
CAS number: 626-38-0
Its molecular formula C7H14O2 comprises 7 C, 14 H, 2 O atoms.
Also known as: 2-Pentyl acetate · 1-methylbutyl acetate
The CAS registry number of 2-Pentyl acetate is 626-38-0.
Molecular formula C7H14O2, molecular weight 130.10 g/mol.
It is also registered under: 2-Pentyl acetate, 1-methylbutyl acetate.
Recorded applications: Used as a solvent for ethyl cellulose, nitrocellulose, printing inks, also used in the production of coatings and cements.
Public-database records for 2-Pentyl acetate (CAS 626-38-0), reproduced here for independent cross-checking.
| Reported hazard statements | H226, H225, H317, H320, H336, H371, H372, H373 |
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H226: Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
| 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 |
|---|
| 沸点 | 271.4 °F at 760 mmHg (USCG, 1999) |
|---|---|
| 沸点 | 130-131 °C |
| 沸点 | 121 °C |
| 沸点 | 135 °C |
| 沸点 | 271 °F |
| 沸点 | 249 °F |
| 熔点 | -95.44 °F (USCG, 1999) |
| 熔点 | -78.5 °C |
| 熔点 | -148 °C |
| 熔点 | -95.44 °F |
| CAS Registry Number | 626-38-0 |
|---|---|
| PubChem CID | 12278 |
| 分子式 | C7H14O2 |
| 分子量 | 130.10 g/mol |
| IUPAC 名称 | pentan-2-yl acetate |
| InChIKey | GQKZRWSUJHVIPE-UHFFFAOYSA-N |
| UNII(FDA) | B570113U4Q |
| ChEBI 编号 | CHEBI:179996 |
| FEMA 编号 | 4012 |
| JECFA 编号 | 1146 |
1-Methylbutyl acetate; 2-PENTYL ACETATE; 626-38-0; sec-Amyl acetate; 2-Pentanol, acetate; 2-Acetoxypentane; 2-pentanol acetate; 2-Pentanol, 2-acetate; Acetic acid, 2-pentyl ester; sec-Pentyl acetate; Pentyl acetate, all isomers; Acetic acid, sec-pentyl ester; HSDB 6291; EINECS 210-946-8; sek.Amylester kyseliny octove; sek.Amylester kyseliny octove [Czech]
| 分子量 | 130.18 |
|---|---|
| XLogP3 | 1.8 |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 4 |
| 精确质量 | 130.099379685 |
| 单同位素质量 | 130.099379685 |
| 拓扑极性表面积 | 26.3 |
| 重原子数 | 9 |
| 形式电荷 | 0 |
2-Pentyl acetate is identified by CAS 626-38-0, molecular formula C7H14O2 and molecular weight 130.10 g/mol. UNII B570113U4Q; ChEBI 179996; InChIKey GQKZRWSUJHVIPE-UHFFFAOYSA-N. 沸点: 271.4 °F at 760 mmHg (USCG, 1999); 沸点: 130-131 °C; 沸点: 121 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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