Phenyl Ethyl Isobutyrate (CAS 2901-13-5) — formula C12H16O2, molecular weight 192.25; category food flavors.
Phenyl Ethyl Isobutyrate is a flavoring compound with CAS registry number 2901-13-5 and molecular formula C12H16O2 (molecular weight 192.25), belonging to the food flavors segment of chemical raw materials.
CAS number: 2901-13-5
Its molecular formula C12H16O2 comprises 12 C, 16 H, 2 O atoms.
Also known as: Phenyl Ethyl Isobutyrate · Ethyl 2,2-dimethylphenylacetate
Category: food flavors
The CAS registry number of Phenyl Ethyl Isobutyrate is 2901-13-5.
Molecular formula C12H16O2, molecular weight 192.25.
It is also registered under: Phenyl Ethyl Isobutyrate, Ethyl 2,2-dimethylphenylacetate.
Category: Flavors & Fragrances.
Public-database records for Phenyl Ethyl Isobutyrate (CAS 2901-13-5), reproduced here for independent cross-checking.
| Reported hazard statements | H412 (100%) |
|---|
H412 (100%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
| CAS Registry Number | 2901-13-5 |
|---|---|
| PubChem CID | 232036 |
| 分子式 | C12H16O2 |
| IUPAC 名称 | ethyl 2-methyl-2-phenylpropanoate |
| UNII（FDA） | NS00006436 |
2901-13-5; Benzeneacetic acid, alpha,alpha-dimethyl-, ethyl ester; alpha,alpha-Dimethyl-ethyl ester benzeneacetic acid; RefChem:1078304; 608-307-7; ethyl 2-methyl-2-phenylpropanoate; Ethyl Dimethylbenzeneacetate; Ethyl 2,2-dimethylphenylacetate; Ethyl Dimethylphenylacetate; MFCD03844687; NSC 29060; 2-methyl-2-phenyl-propionic acid ethyl ester; ethyl alpha,alpha-dimethylphenylacetate; SY002718; 2-Methyl-2-phenylpropionic acid ethyl ester; Ethyl 2-methyl-2-phenylpropionate
| 分子量 | 192.25 |
|---|---|
| XLogP3 | 3 |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 4 |
| 精确质量 | 192.115029749 |
| 单同位素质量 | 192.115029749 |
| 拓扑极性表面积 | 26.3 |
| 重原子数 | 14 |
| 形式电荷 | 0 |
Phenyl Ethyl Isobutyrate · CAS 2901-13-5 · C12H16O2. UNII NS00006436.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd. · Reply within one business day.