3-(3-Fluorophenyl)propionic acid (CAS 458-45-7) — formula C9H9FO2, molecular weight 168.16; category organic chemicals.
| CAS Number | 458-45-7 |
|---|---|
| Molecular Formula | C9H9FO2 |
| Molecular Weight | 168.16 |
| LogP | 1.8 |
| Applications | General Manufacturing Information: Benzenepropanoic acid, 3-fluoro-: ACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: Benzenepropanoic acid, 3-fluoro-: ACTIVE.
3-(3-Fluorophenyl)propionic acid is a carbon-based organic compound with CAS registry number 458-45-7 and molecular formula C9H9FO2 (molecular weight 168.16), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 458-45-7
Its molecular formula C9H9FO2 comprises 9 C, 9 H, 1 F, 2 O atoms.
Also known as: 3-(3-Fluorophenyl)propionic acid · 3-(3-氟苯基)丙酸
Category: organic chemicals
The CAS registry number of 3-(3-Fluorophenyl)propionic acid is 458-45-7.
Molecular formula C9H9FO2, molecular weight 168.16.
It is also registered under: 3-(3-Fluorophenyl)propionic acid, 3-(3-氟苯基)丙酸.
Recorded applications: General Manufacturing Information: Benzenepropanoic acid, 3-fluoro-: ACTIVE.
Category: Organic Chemicals.
Independent reference data for 3-(3-Fluorophenyl)propionic acid (CAS 458-45-7), compiled from public chemistry databases.
| CAS Registry Number | 458-45-7 |
|---|---|
| PubChem CID | 2737489 |
| Molecular formula | C9H9FO2 |
| IUPAC name | 3-(3-fluorophenyl)propanoic acid |
| UNII (FDA) | Z185153196 |
| Molecular Weight | 168.16 |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 168.05865769 |
| Monoisotopic Mass | 168.05865769 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 12 |
3-(3-Fluorophenyl)propionic acid; 458-45-7; DTXSID20372094; RefChem:92314; DTXCID20323127; 626-825-1; 3-(3-fluorophenyl)propanoic acid; MFCD01310821; 3-Fluorohydrocinnamic acid; 3-Fluorophenylpropionic acid; 3-(3-Fluoro-phenyl)-propionic acid; BENZENEPROPANOIC ACID, 3-FLUORO-; 3-(3-Fluorophenyl) propionic acid; 3-FLUORO-BENZENEPROPANOIC ACID; CS-W017812; F0779
| Reported hazard statements | H302 (90.5%), H315 (100%), H318 (90.5%), H335 (98.6%) |
|---|
H302 (90.5%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
3-(3-Fluorophenyl)propionic acid · CAS 458-45-7 · C9H9FO2. UNII Z185153196.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-(3-氟苯基)丙酸