Related Products
- 3,10-Diaminotricyclo(5.2.1.0(sup 2,6))decane
- 3,10-Dinitrophenanthrene
- 3-((10-ETHYL-11-(p-HYDROXYPHENYL)DIBENZ-(B,F)OXEPIN-3-YL)OXY)-1,2-PROPANEDIOL HYDRATE (4:1)
- 3-(1,1,2,2-Tetrafluoroethoxy)aniline
- 3-(1,1,2,2-Tetrafluoroethoxy)benzaldehyde
- 3-(1,1,2,2-Tetrafluoroethoxy)bromobenzene
- 3-(1,1,2,2-Tetrafluoroethoxy)toluene
- 3-[1,1'-Biphenyl]-4-yl-1,2,3,4-tetrahydro-1-naphthol
- 3,11-Dichloro-6,11-dihydro-6-methyldibenzo[c,f][1,2]thiazepine 5,5-dioxide
- 3-[(1,1-Dimethyl-2-hydroxyethyl)amino]-2-hydroxypropanesulfonicacid
- 121-60-8N-Acetylsulfanilyl chloride
- 121-61-9Acetamide,N-[4-(aminosulfonyl)phenyl]-
- 121-62-0Benzenesulfonic acid,4-(acetylamino)-
- 121625-31-87,7,13,13,23,23,29,29-Octamethyl-7,13,23,29-tetraazoniapentacyclo(28.2.2.23,6.214,17.219,22)tetraconta-3,5,14,16,19,21,30,32,33,35,37,39-dodecaene tetrachloride
- 12162-58-2Diholmium dioxide sulphide
- 121629-14-9Cyclohexanecarboxylicacid, 4,4-difluoro-, methyl ester
- 121-63-1Benzenesulfonylchloride, 4,4'-oxybis-
- 12163-59-6Trimanganese silicide
- 121643-44-5Pyridine,2-methoxy-3-(trifluoromethyl)-
- 121643-47-82-Chloro-6-methoxypyridine-3-carbonitrile
Hot Products
- 104987-11-3Tacrolimus
- 141-53-7Sodium formate
- 8001-54-5Quaternary ammonium compounds, alkylbenzyldimethyl, chlorides
- 9003-39-8Povidone
- 10161-34-9Trenbolone acetate
- 402957-28-2Telaprevir
- 68-19-9Cyanocobalamin
- 7631-86-9Silicon dioxide
- 302-79-4Tretinoin
- 77-92-9Citric acid
|
Basic Information |
|
Post buying leads |
|
Suppliers |
|
Cas Database |
| Name |
3,4,5-Trifluorobenzoic acid |
EINECS | 624-063-4 |
| CAS No. | 121602-93-5 | Density | 1.536 g/cm3 |
| PSA | 37.30000 | LogP | 1.80210 |
| Solubility | N/A | Melting Point |
95-99 °C |
| Formula | C7H3F3O2 | Boiling Point | 251.4 °C at 760 mmHg |
| Molecular Weight | 176.095 | Flash Point | 105.9 °C |
| Transport Information | N/A | Appearance | white to light yellow crystal powder |
| Safety | 26-37/39 | Risk Codes | 36/37/38 |
| Molecular Structure |
|
Hazard Symbols |
 Xi
|
| Synonyms |
3,4,5-Trifluorobenzoicacid;3,4,5-trifluorobenzoate; |
Article Data | 7 |
3,4,5-Trifluorobenzoic acid Synthetic route
- 124-38-9
carbon dioxide
- 138526-69-9
3,4,5-trifluoro-1-bromobenzene
- 121602-93-5
3,4,5-trifluorobenzoic acid
Conditions
| Conditions | Yield |
|---|---|
| With n-butyllithium In diethyl ether; hexane at -75℃; for 0.25h; | 93% |
| Stage #1: 3,4,5-trifluoro-1-bromobenzene With magnesium Metallation; Stage #2: carbon dioxide Carboxylation; Grignard reaction; |
- 456-22-4
4-Fluorobenzoic acid
A
- 1201-31-6
2,3,4,5-tetrafluorobenzoic acid
B
- 455-86-7
3,4-Difluorobenzoic acid
C
- 446-17-3
2,4,5-trifluorobenzoic acid
D
- 61079-72-9
2,3,4,-trifluorobenzoic acid
E
- 121602-93-5
3,4,5-trifluorobenzoic acid
F
- 1583-58-0
2,4-difluoro-benzoic acid
Conditions
| Conditions | Yield |
|---|---|
| With fluorine In sulfuric acid Product distribution; various substrate to fluorine ratios; also in 98percent HCOOH; |
...Expand
- 602-94-8
Pentafluorobenzoic acid
A
- 1201-31-6
2,3,4,5-tetrafluorobenzoic acid
B
- 121602-93-5
3,4,5-trifluorobenzoic acid
Conditions
| Conditions | Yield |
|---|---|
| With 1,10-Phenanthroline; nickel dichloride; zinc In water; N,N-dimethyl-formamide at 50℃; for 6h; Product distribution; Further Variations:; Reagents; Temperatures; reaction time; Hydrodefluorination; |
- 1489-53-8
1,2,3-trifluorobenzene
- 121602-93-5
3,4,5-trifluorobenzoic acid
Conditions
| Conditions | Yield |
|---|---|
| Multi-step reaction with 5 steps 1: 91 percent / sec-butyllithium / tetrahydrofuran; cyclohexane / 1.5 h / -75 °C 2: 95 percent / bromine / CCl4 / Heating 3: diisopropylamine; butyllithium / hexane; tetrahydrofuran / 2 h / -75 °C 4: 89 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 5: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme | |
| Multi-step reaction with 6 steps 1: 91 percent / sec-butyllithium / tetrahydrofuran; cyclohexane / 1.5 h / -75 °C 2: 95 percent / bromine / CCl4 / Heating 3: 67 percent / diisopropylamine; butyllithium; tetrabromomethane / hexane; tetrahydrofuran / 2 h / -75 °C 4: 92 percent / butylmagnesium chloride; butyllithium / tetrahydrofuran; hexane; toluene / 0.75 h / 0 °C 5: 89 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 6: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme | |
| Multi-step reaction with 4 steps 1.1: 91 percent / sec-butyllithium / tetrahydrofuran; cyclohexane / 1.5 h / -75 °C 2.1: 95 percent / bromine / CCl4 / Heating 3.1: diisopropylamine; butyllithium / tetrahydrofuran; hexane / 2 h / -75 °C 3.2: 75 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 4.1: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme |
- 17299-94-4
1,2-dibromo-3,4,5-trifluorobenzene
- 121602-93-5
3,4,5-trifluorobenzoic acid
Conditions
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: 89 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 2: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme |
- 17299-95-5
1,5-dibromo-2,3,4-trifluorobenzene
- 121602-93-5
3,4,5-trifluorobenzoic acid
Conditions
| Conditions | Yield |
|---|---|
| Multi-step reaction with 3 steps 1: diisopropylamine; butyllithium / hexane; tetrahydrofuran / 2 h / -75 °C 2: 89 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 3: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme | |
| Multi-step reaction with 4 steps 1: 67 percent / diisopropylamine; butyllithium; tetrabromomethane / hexane; tetrahydrofuran / 2 h / -75 °C 2: 92 percent / butylmagnesium chloride; butyllithium / tetrahydrofuran; hexane; toluene / 0.75 h / 0 °C 3: 89 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 4: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme | |
| Multi-step reaction with 2 steps 1.1: diisopropylamine; butyllithium / tetrahydrofuran; hexane / 2 h / -75 °C 1.2: 75 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 2.1: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme |
- 34628-01-8
1,2,3-tribromo-4,5,6-trifluoro-benzene
- 121602-93-5
3,4,5-trifluorobenzoic acid
Conditions
| Conditions | Yield |
|---|---|
| Multi-step reaction with 3 steps 1: 92 percent / butylmagnesium chloride; butyllithium / tetrahydrofuran; hexane; toluene / 0.75 h / 0 °C 2: 89 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 3: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme |
- 176317-02-5
1-bromo-2,3,4-trifluorobenzene
- 121602-93-5
3,4,5-trifluorobenzoic acid
Conditions
| Conditions | Yield |
|---|---|
| Multi-step reaction with 5 steps 1: 92 percent / diisopropylamine; butyllithium / hexane; tetrahydrofuran / 2 h / -75 °C 2: 93 percent / bromine / CCl4 / 36 h / Heating 3: diisopropylamine; butyllithium / hexane; tetrahydrofuran / 2 h / -75 °C 4: 89 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 5: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme | |
| Multi-step reaction with 6 steps 1: 92 percent / diisopropylamine; butyllithium / hexane; tetrahydrofuran / 2 h / -75 °C 2: 93 percent / bromine / CCl4 / 36 h / Heating 3: 67 percent / diisopropylamine; butyllithium; tetrabromomethane / hexane; tetrahydrofuran / 2 h / -75 °C 4: 92 percent / butylmagnesium chloride; butyllithium / tetrahydrofuran; hexane; toluene / 0.75 h / 0 °C 5: 89 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 6: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme | |
| Multi-step reaction with 4 steps 1.1: 92 percent / diisopropylamine; butyllithium / hexane; tetrahydrofuran / 2 h / -75 °C 2.1: 93 percent / bromine / CCl4 / 36 h / Heating 3.1: diisopropylamine; butyllithium / tetrahydrofuran; hexane / 2 h / -75 °C 3.2: 75 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 4.1: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme |
- 530145-56-3
(5-bromo-2,3,4-trifluorophenyl)triethylsilane
- 121602-93-5
3,4,5-trifluorobenzoic acid
Conditions
| Conditions | Yield |
|---|---|
| Multi-step reaction with 4 steps 1: 93 percent / bromine / CCl4 / 36 h / Heating 2: diisopropylamine; butyllithium / hexane; tetrahydrofuran / 2 h / -75 °C 3: 89 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 4: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme | |
| Multi-step reaction with 5 steps 1: 93 percent / bromine / CCl4 / 36 h / Heating 2: 67 percent / diisopropylamine; butyllithium; tetrabromomethane / hexane; tetrahydrofuran / 2 h / -75 °C 3: 92 percent / butylmagnesium chloride; butyllithium / tetrahydrofuran; hexane; toluene / 0.75 h / 0 °C 4: 89 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 5: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme | |
| Multi-step reaction with 3 steps 1.1: 93 percent / bromine / CCl4 / 36 h / Heating 2.1: diisopropylamine; butyllithium / tetrahydrofuran; hexane / 2 h / -75 °C 2.2: 75 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 3.1: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme |
- 530145-55-2
2,3,4-trifluoro-1,5-phenylenebis(triethylsilane)
- 121602-93-5
3,4,5-trifluorobenzoic acid
Conditions
| Conditions | Yield |
|---|---|
| Multi-step reaction with 4 steps 1: 95 percent / bromine / CCl4 / Heating 2: diisopropylamine; butyllithium / hexane; tetrahydrofuran / 2 h / -75 °C 3: 89 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 4: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme | |
| Multi-step reaction with 5 steps 1: 95 percent / bromine / CCl4 / Heating 2: 67 percent / diisopropylamine; butyllithium; tetrabromomethane / hexane; tetrahydrofuran / 2 h / -75 °C 3: 92 percent / butylmagnesium chloride; butyllithium / tetrahydrofuran; hexane; toluene / 0.75 h / 0 °C 4: 89 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 5: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme | |
| Multi-step reaction with 3 steps 1.1: 95 percent / bromine / CCl4 / Heating 2.1: diisopropylamine; butyllithium / tetrahydrofuran; hexane / 2 h / -75 °C 2.2: 75 percent / butyllithium / diethyl ether; hexane / 0.25 h / -100 °C 3.1: 93 percent / butyllithium / diethyl ether; hexane / 0.25 h / -75 °C View Scheme |
3,4,5-Trifluorobenzoic acid Chemical Properties
Molecular Formula:C7H3F3O2
Molar mass:176.09273g/mol
Structure :
Synonyms :3,4,5-Trifluorobenzoic;3-flurobenzenenitrile
Density:1.536 g/cm3
Flash Point:105.9 °C
Boiling Point:251.4 °C at 760 mmHg
Index of Refraction:1.49
Vapour Pressure:0.0107 mmHg at 25°C
Melting point:97-99 °C(lit.)
Appearance:white to light yellow crystal powder
Molar mass:176.09273g/mol
Structure :
Synonyms :3,4,5-Trifluorobenzoic;3-flurobenzenenitrile
Density:1.536 g/cm3
Flash Point:105.9 °C
Boiling Point:251.4 °C at 760 mmHg
Index of Refraction:1.49
Vapour Pressure:0.0107 mmHg at 25°C
Melting point:97-99 °C(lit.)
Appearance:white to light yellow crystal powder
3,4,5-Trifluorobenzoic acid Uses
3,4,5-Trifluorobenzoic acid(121602-93-5) can be used as intermediates of medicine, pesticide and liquid crystal.
3,4,5-Trifluorobenzoic acid Toxicity Data With Reference
Carcinogenicity:3,4,5-Trifluorobenzoic acid(121602-93-5) hasn't been listed as a carcinogen by NTP, IARC,ACGIH, or CA Prop 65.
3,4,5-Trifluorobenzoic acid Safety Profile
Hazard Codes:Xi
Risk Statements:
36: Irritating to the eyes
37: Irritating to the respiratory system
38: Irritating to the skin
Safety Statements:
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing
37: Wear suitable gloves
39: Wear eye/face protection
Risk Statements:
36: Irritating to the eyes
37: Irritating to the respiratory system
38: Irritating to the skin
Safety Statements:
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing
37: Wear suitable gloves
39: Wear eye/face protection
3,4,5-Trifluorobenzoic acid Specification
Stability and Reactivity of 3,4,5-Trifluorobenzoic acid(121602-93-5):
Conditions to Avoid:Incompatible materials.
Incompatibilities with Other Materials: Strong acids, strong bases, strong reducing agents, strong oxidizing agents.
Hazardous Decomposition Products:Carbon dioxide, hydrogen fluoride gas, carbon monoxide.
Conditions to Avoid:Incompatible materials.
Incompatibilities with Other Materials: Strong acids, strong bases, strong reducing agents, strong oxidizing agents.
Hazardous Decomposition Products:Carbon dioxide, hydrogen fluoride gas, carbon monoxide.
Post a RFQ
1
What can I do for you?
Get Best Price
Get Best Price for 121602-93-5
3,4,5-Trifluorobenzoic acid
