Phenyl nicotinate (CAS 3468-53-9) — formula C12H9NO2, molecular weight 199.20; category organic chemicals.
| CAS Number | 3468-53-9 |
|---|---|
| Molecular Formula | C12H9NO2 |
| Molecular Weight | 199.20 |
| LogP | 2.4 |
| Applications | General Manufacturing Information: 3-Pyridinecarboxylic acid, phenyl ester: INACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: 3-Pyridinecarboxylic acid, phenyl ester: INACTIVE.
Phenyl nicotinate is a carbon-based organic compound with CAS registry number 3468-53-9 and molecular formula C12H9NO2 (molecular weight 199.20), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 3468-53-9
Its molecular formula C12H9NO2 comprises 12 C, 9 H, 1 N, 2 O atoms.
Also known as: Phenyl nicotinate · 烟酸苯酯
Category: organic chemicals
The CAS registry number of Phenyl nicotinate is 3468-53-9.
Molecular formula C12H9NO2, molecular weight 199.20.
It is also registered under: Phenyl nicotinate, 烟酸苯酯.
Recorded applications: General Manufacturing Information: 3-Pyridinecarboxylic acid, phenyl ester: INACTIVE.
Category: Organic Chemicals.
Independent reference data for Phenyl nicotinate (CAS 3468-53-9), compiled from public chemistry databases.
| CAS Registry Number | 3468-53-9 |
|---|---|
| PubChem CID | 77018 |
| Molecular formula | C12H9NO2 |
| IUPAC name | phenyl pyridine-3-carboxylate |
| UNII (FDA) | VRD2L6RM16 |
| Molecular Weight | 199.20 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 199.063328530 |
| Monoisotopic Mass | 199.063328530 |
| Topological Polar Surface Area | 39.2 |
| Heavy Atom Count | 15 |
Phenyl nicotinate; 3468-53-9; Phenyl 3-pyridinecarboxylate; VRD2L6RM16; NSC-75878; DTXSID3063045; RefChem:861622; DTXCID0038887; 222-428-9; phenyl pyridine-3-carboxylate; Phenylnicotinate; 3-Pyridinecarboxylic acid, phenyl ester; Nicotinic Acid Phenyl Ester; Nicotinic acid, phenyl ester; MFCD00023581; UNII-VRD2L6RM16
| Reported hazard statements | H315 (11.4%), H318 (100%) |
|---|
H315 (11.4%): Causes skin irritation [Warning Skin corrosion/irritation]
H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Phenyl nicotinate · CAS 3468-53-9 · C12H9NO2. UNII VRD2L6RM16.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 烟酸苯酯