Name | Pentafluorobenzoic acid |
Synonyms | RARECHEM AL BO 0017 pentafluorobenzoate PERFLUOROBENZOIC ACID entafluorobenzoic acid pentafluoro-benzoicaci Pentafluorobenzoic acid PENTAFLUOROBENZOIC ACID 2,3,4,5,6-pentafluoropropane acid 2,3,4,5,6-Pentafluorobenzoic acid 2,3,4,5,6-Pentafluoro Benzoic Acid 1-PHENYLSULPHONYLINDOLE-5-CARBOXYLIC ACID (2-fluoro-4-methoxycarbonyl-phenyl)boronic acid |
CAS | 602-94-8 |
EINECS | 210-026-6 |
InChI | InChI=1/C8H8BFO4/c1-14-8(11)5-2-3-6(9(12)13)7(10)4-5/h2-4,12-13H,1H3 |
InChIKey | YZERDTREOUSUHF-UHFFFAOYSA-N |
Molecular Formula | C7HF5O2 |
Molar Mass | 212.07 |
Density | 1,944 g/cm3 |
Melting Point | 100-102 °C (lit.) |
Boling Point | 220 °C (lit.) |
Flash Point | 219-221°C |
Vapor Presure | 1.17E-05mmHg at 25°C |
Appearance | White to yellow crystalline powder |
Color | white |
BRN | 2054395 |
pKa | 1.75(at 25℃) |
Storage Condition | Sealed in dry,Room Temperature |
Refractive Index | 1.513 |
MDL | MFCD00002406 |
Physical and Chemical Properties | Melting Point: 100-104°C Boiling Point: 220°C |
Use | Used as a pharmaceutical Intermediate |
Risk Codes | R25 - Toxic if swallowed R36/37/38 - Irritating to eyes, respiratory system and skin. |
Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S45 - In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) S36/37/39 - Wear suitable protective clothing, gloves and eye/face protection. S24/25 - Avoid contact with skin and eyes. |
UN IDs | UN 2811 6.1/PG 3 |
WGK Germany | 3 |
RTECS | DH6195000 |
TSCA | T |
HS Code | 29163900 |
Hazard Class | IRRITANT |
Toxicity | LD50 ipr-mus: 178 mg/kg JMCMAR 11,1020,68 |
NIST chemical information | information provided by: webbook.nist.gov (external link) |
EPA chemical substance information | information provided by: ofmpeb.epa.gov (external link) |
Use | for pharmaceutical intermediates |