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Phenyl nicotinate · CAS 3468-53-9 · C12H9NO2. UNII VRD2L6RM16.
| 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 |
| Formal Charge | 0 |
| 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; 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
CAS 3468-53-9; molecular formula C12H9NO2; molecular weight — g/mol.
Phenyl nicotinate, 3468-53-9, Phenyl 3-pyridinecarboxylate, VRD2L6RM16, NSC-75878, DTXSID3063045.
Hazard statements reported: H315, H318.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.