3-(4-Ethylbenzoyl)propionic acid (CAS 49594-75-4) — formula C12H14O3, molecular weight 206.24; category organic chemicals.
| CAS Number | 49594-75-4 |
|---|---|
| Molecular Formula | C12H14O3 |
| Molecular Weight | 206.24 |
| LogP | 2.4 |
| Category | Organic Chemicals |
3-(4-Ethylbenzoyl)propionic acid is a carbon-based organic compound with CAS registry number 49594-75-4 and molecular formula C12H14O3 (molecular weight 206.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 49594-75-4
Its molecular formula C12H14O3 comprises 12 C, 14 H, 3 O atoms.
Also known as: 3-(4-Ethylbenzoyl)propionic acid · 3-(4-乙基苯甲酰基)丙酸
Category: organic chemicals
The CAS registry number of 3-(4-Ethylbenzoyl)propionic acid is 49594-75-4.
Molecular formula C12H14O3, molecular weight 206.24.
It is also registered under: 3-(4-Ethylbenzoyl)propionic acid, 3-(4-乙基苯甲酰基)丙酸.
Category: Organic Chemicals.
Independent reference data for 3-(4-Ethylbenzoyl)propionic acid (CAS 49594-75-4), compiled from public chemistry databases.
| CAS Registry Number | 49594-75-4 |
|---|---|
| PubChem CID | 316983 |
| Molecular formula | C12H14O3 |
| IUPAC name | 4-(4-ethylphenyl)-4-oxobutanoic acid |
| UNII (FDA) | ST45021898 |
| Molecular Weight | 206.24 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 206.094294304 |
| Monoisotopic Mass | 206.094294304 |
| Topological Polar Surface Area | 54.4 |
| Heavy Atom Count | 15 |
4-(4-Ethylphenyl)-4-oxobutanoic acid; 49594-75-4; 3-(4-Ethylbenzoyl)propionic acid; MFCD00173766; 4-(4-Ethylphenyl)-4-oxobutyric acid; Benzenebutanoic acid, 4-ethyl-gamma-oxo-; NSC246068; Maybridge1_002070; 4-OXO-4-(4-ETHYLPHENYL)BUTYRIC ACID; Oprea1_304761; orb3030978; SCHEMBL5081078; HMS547G02; DTXSID30311853; 3-(4-ethylbenzoyl)-propionic acid; Fr13084
| Reported hazard statements | H315 (100%), H319 (100%), H335 (100%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
3-(4-Ethylbenzoyl)propionic acid · CAS 49594-75-4 · C12H14O3. UNII ST45021898.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-(4-乙基苯甲酰基)丙酸