异丁酸丁酯（CAS 97-87-0）：分子式 C8H16O2、分子量 144.21。
| CAS号 | 97-87-0 |
|---|---|
| 分子式 | C8H16O2 |
| 分子量 | 144.21 |
| 熔点 | < 25 °C |
| 沸点 | 156.00 to 158.00 °C. @ 760.00 mm Hg |
| LogP | 2.4 |
异丁酸丁酯 是一种化工化合物，登记 CAS 号为 97-87-0，分子式 C8H16O2（分子量 144.21）。
登记 CAS 号：97-87-0
其分子式 C8H16O2 由 8 个碳、16 个氢、2 个氧 组成。
别名/同义词：异丁酸丁酯 · butyl isobutyrate
异丁酸丁酯 的 CAS 登记号为 97-87-0。
分子式 C8H16O2，分子量 144.21。
别名/同义词：异丁酸丁酯、butyl isobutyrate。
异丁酸丁酯（CAS 97-87-0）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 97-87-0 |
|---|---|
| PubChem CID | 7353 |
| Molecular formula | C8H16O2 |
| Molecular weight | 144.12 g/mol |
| IUPAC name | butyl 2-methylpropanoate |
| InChIKey | JSLCOZYBKYHZNL-UHFFFAOYSA-N |
| UNII (FDA) | PW9UJ5C0F3 |
| ChEBI ID | CHEBI:179935 |
| FEMA number | 2188 |
| JECFA number | 188 |
| Molecular Weight | 144.21 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 144.115029749 |
| Monoisotopic Mass | 144.115029749 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 10 |
| Boiling Point | 156.00 to 158.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 166 °C |
| Melting Point | < 25 °C |
| Density | 0.859-0.864 |
| Refractive Index | 1.401-1.404 |
Butyl isobutyrate; 97-87-0; Butyl 2-methylpropanoate; Butyl isobutanoate; Propanoic acid, 2-methyl-, butyl ester; Isobutyric acid, butyl ester; n-Butyl isobutyrate; FEMA No. 2188; MFCD00048773; PW9UJ5C0F3; Isobutyric acid n-butyl ester; Butyl ester of 2-methylpropanoic acid; Butyl isobutyrate; n-Butyl isobutyrate; BUTYLISOBUTYRATE; Butyl isobutyrate (natural); Isobutyric Acid Butyl Ester
| 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 |
|---|
| Reported hazard statements | H226 (100%) |
|---|
H226 (100%): 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)
butyl isobutyrate is identified by CAS 97-87-0, molecular formula C8H16O2 and molecular weight 144.12 g/mol. UNII PW9UJ5C0F3; ChEBI 179935; InChIKey JSLCOZYBKYHZNL-UHFFFAOYSA-N. Boiling Point: 156.00 to 158.00 °C. @ 760.00 mm Hg; Boiling Point: 166 °C; Melting Point: < 25 °C.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: butyl isobutyrate