新戊酰乙酸甲酯（CAS 55107-14-7）：分子式 C8H14O3、分子量 158.19。
| CAS号 | 55107-14-7 |
|---|---|
| 分子式 | C8H14O3 |
| 分子量 | 158.19 |
| LogP | 1.4 |
| 应用领域 | General Manufacturing Information: Pentanoic acid、4、4-dimethyl-3-oxo-、methyl ester: ACTIVE |
登记用途：General Manufacturing Information: Pentanoic acid、4、4-dimethyl-3-oxo-、methyl ester: ACTIVE。
新戊酰乙酸甲酯 是一种化工化合物，登记 CAS 号为 55107-14-7，分子式 C8H14O3（分子量 158.19）。
登记 CAS 号：55107-14-7
其分子式 C8H14O3 由 8 个碳、14 个氢、3 个氧 组成。
别名/同义词：新戊酰乙酸甲酯 · Pivaloylacetic acid methyl ester
新戊酰乙酸甲酯 的 CAS 登记号为 55107-14-7。
分子式 C8H14O3，分子量 158.19。
别名/同义词：新戊酰乙酸甲酯、Pivaloylacetic acid methyl ester。
登记用途：General Manufacturing Information: Pentanoic acid、4、4-dimethyl-3-oxo-、methyl ester: ACTIVE。
新戊酰乙酸甲酯（CAS 55107-14-7）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 55107-14-7 |
|---|---|
| PubChem CID | 99597 |
| Molecular formula | C8H14O3 |
| IUPAC name | methyl 4,4-dimethyl-3-oxopentanoate |
| UNII (FDA) | 99CQ34TA4Y |
| Molecular Weight | 158.19 |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 158.094294304 |
| Monoisotopic Mass | 158.094294304 |
| Topological Polar Surface Area | 43.4 |
| Heavy Atom Count | 11 |
Methyl 4,4-dimethyl-3-oxopentanoate; Methyl pivaloylacetate; Methyl 4,4-dimethyl-3-oxovalerate; Pentanoic acid, 4,4-dimethyl-3-oxo-, methyl ester; Pivaloylacetic Acid Methyl Ester; Methyl 4,4,4-trimethylacetoacetate; UNII-99CQ34TA4Y; 99CQ34TA4Y; DTXSID2042149; Methyl 4,4,4-trimethyl-3-oxobutanoate; EINECS 259-481-2; 4,4-Dimethyl-3-oxovaleric Acid Methyl Ester; NSC 246205; Methyl 3-oxo-4,4-dimethylpentanoate; NSC-246205; DTXCID0022149
| Reported hazard statements | H315 (100%), H319 (100%), H335 (97.7%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Pivaloylacetic acid methyl ester · CAS 55107-14-7 · C8H14O3. UNII 99CQ34TA4Y.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: Pivaloylacetic acid methyl ester