Pentafluorobenzoic acid (CAS 602-94-8) — formula C7HF5O2, molecular weight 212.07; category organic chemicals.
Pentafluorobenzoic acid (CAS 602-94-8) is a chemical raw material in the organic chemicals category. Its molecular formula C7HF5O2 comprises 7 C, 1 H, 5 F, 2 O atoms. Its molecular weight is about 212.07. Reported physicochemical data: boiling point around 220 °C @760 [mm Hg], LogP about 2. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.
| CAS Number | 602-94-8 |
|---|---|
| Molecular Formula | C7HF5O2 |
| Molecular Weight | 212.07 |
| Boiling Point | 220 °C @760 [mm Hg] |
| LogP | 2 |
| Applications | Synthetic Polymer MALDI Matrix Compounds, Benzoic acid, 6-pentafluoro-: ACTIVE |
| Category | Organic Chemicals |
Documented applications: Synthetic Polymer MALDI Matrix Compounds, Benzoic acid, 6-pentafluoro-: ACTIVE.
Pentafluorobenzoic acid is a carbon-based organic compound with CAS registry number 602-94-8 and molecular formula C7HF5O2 (molecular weight 212.07), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 602-94-8
Its molecular formula C7HF5O2 comprises 7 C, 1 H, 5 F, 2 O atoms.
Also known as: Pentafluorobenzoic acid · 五氟苯甲酸
Category: organic chemicals
The CAS registry number of Pentafluorobenzoic acid is 602-94-8.
Molecular formula C7HF5O2, molecular weight 212.07.
It is also registered under: Pentafluorobenzoic acid, 五氟苯甲酸.
Recorded applications: Synthetic Polymer MALDI Matrix Compounds, Benzoic acid, 6-pentafluoro-: ACTIVE.
Category: Organic Chemicals.
Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.
Independent reference data for Pentafluorobenzoic acid (CAS 602-94-8), compiled from public chemistry databases.
| CAS Registry Number | 602-94-8 |
|---|---|
| PubChem CID | 11770 |
| Molecular formula | C7HF5O2 |
| IUPAC name | 2,3,4,5,6-pentafluorobenzoic acid |
| UNII (FDA) | B4JCP8R5GJ |
| Molecular Weight | 212.07 |
|---|---|
| XLogP3 | 2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 1 |
| Exact Mass | 211.98967008 |
| Monoisotopic Mass | 211.98967008 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 14 |
| Boiling Point | 220 °C @760 [mm Hg] |
|---|---|
| Ionization Efficiency | 0.61 |
| Ionization Efficiency | 10.5 |
| Ionization Efficiency | MeCN (80%) |
Pentafluorobenzoic acid; 602-94-8; 2,3,4,5,6-Pentafluorobenzoic acid; Perfluorobenzoic acid; BENZOIC ACID, PENTAFLUORO-; B4JCP8R5GJ; DTXSID4060527; NSC-88337; CHEBI:46796; RefChem:859803; DTXCID7042772; 210-026-6; C7HF5O2; 2,3,4,5,6-Pentafluorobenzoicacid; MFCD00002406; BRN 2054395
| Reported hazard statements | H301 (67.2%), H302 (19%), H315 (100%), H319 (100%), H335 (98.3%) |
|---|
H301 (67.2%): Toxic if swallowed [Danger Acute toxicity, oral]
H302 (19%): Harmful if swallowed [Warning Acute toxicity, oral]
Pentafluorobenzoic acid · CAS 602-94-8 · C7HF5O2. UNII B4JCP8R5GJ. Boiling Point: 220 °C @760 [mm Hg]; Ionization Efficiency: 0.61; Ionization Efficiency: 10.5.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 五氟苯甲酸