Methyl 4-cyano-3-fluorobenzoate (CAS 268734-34-5) — formula C9H6FNO2, molecular weight 179.15; category organic chemicals.
| CAS Number | 268734-34-5 |
|---|---|
| Molecular Formula | C9H6FNO2 |
| Molecular Weight | 179.15 |
| LogP | 1.6 |
| Category | Organic Chemicals |
Methyl 4-cyano-3-fluorobenzoate is a carbon-based organic compound with CAS registry number 268734-34-5 and molecular formula C9H6FNO2 (molecular weight 179.15), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 268734-34-5
Its molecular formula C9H6FNO2 comprises 9 C, 6 H, 1 F, 1 N, 2 O atoms.
Also known as: Methyl 4-cyano-3-fluorobenzoate · 4-氰基-3-氟苯甲酸甲酯
Category: organic chemicals
The CAS registry number of Methyl 4-cyano-3-fluorobenzoate is 268734-34-5.
Molecular formula C9H6FNO2, molecular weight 179.15.
It is also registered under: Methyl 4-cyano-3-fluorobenzoate, 4-氰基-3-氟苯甲酸甲酯.
Category: Organic Chemicals.
Independent reference data for Methyl 4-cyano-3-fluorobenzoate (CAS 268734-34-5), compiled from public chemistry databases.
| CAS Registry Number | 268734-34-5 |
|---|---|
| PubChem CID | 17965941 |
| Molecular formula | C9H6FNO2 |
| IUPAC name | methyl 4-cyano-3-fluorobenzoate |
| Molecular Weight | 179.15 |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 179.03825660 |
| Monoisotopic Mass | 179.03825660 |
| Topological Polar Surface Area | 50.1 |
| Heavy Atom Count | 13 |
Methyl 4-cyano-3-fluorobenzoate; 268734-34-5; DTXSID20591809; RefChem:355690; DTXCID20542573; 690-000-2; MFCD09264509; Methyl4-cyano-3-fluorobenzoate; Benzoic acid, 4-cyano-3-fluoro-, methyl ester; SCHEMBL1275177; methyl-4-cyano-3-fluorobenzoate; CL8569; BBL102708; STL556514; AKOS005257098; CS-W000768
| Reported hazard statements | H301, H311, H331 (50%), H302 (50%), H312 (50%), H315 (50%), H319 (50%), H332 (50%) |
|---|
H301+H311+H331 (50%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Methyl 4-cyano-3-fluorobenzoate · CAS 268734-34-5 · C9H6FNO2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-氰基-3-氟苯甲酸甲酯