- Preparation of [(Fluoroalkoxy)benzylamino]piperidine derivatives as substance P receptor antagonists, United States, , ,
Cas no 94651-33-9 (2-(Trifluoromethoxy)benzaldehyde)
94651-33-9 structure
Product Name:2-(Trifluoromethoxy)benzaldehyde
CAS No:94651-33-9
MF:C8H5F3O2
MW:190.119313001633
MDL:MFCD00042405
CID:61740
PubChem ID:2777192
Update Time:2024-10-25
2-(Trifluoromethoxy)benzaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 2-(TRIFLUOROMETHOXY)BENZALDEHYDE
- o-(Trifluoromethoxy)benzaldehyde
- 4-Trifluoromethoxy
- 2-trifluoromethoxybenzaldehyde
- 2-trifluoromethoxy-benzaldehyde
- PubChem1469
- 2-(TRIFLUOROMETHOXY)-BENZALDEHYDE
- trifluoromethoxybenzaldehyde
- o-trifluoromethoxybenzaldehyde
- (trifluoromethoxy)benzaldehyde
- KSC457M1D
- 2-trifluoromethoxy benzaldehyde
- 2-(trifluoromethoxy) benzaldehyde
- Benzaldehyde, (trifluoromethoxy)-
- CPHXLF
- 2-(Trifluoromethoxy)benzaldehyde (ACI)
- STK801541
- CS-W015915
- Z166606586
- MFCD00042405
- F2191-0159
- T2302
- EN300-23837
- 2-[(trifluoromethyl)oxy]benzaldehyde
- DB-019547
- SCHEMBL96815
- 94651-33-9
- PS-8385
- AKOS001284212
- DTXSID60915383
- CHEMBL4536848
- 2-(Trifluoromethoxy)benzaldehyde, 96%
- AC-3863
- 2-(Trifluoromethoxy)benzaldehyde
-
- MDL: MFCD00042405
- Inchi: 1S/C8H5F3O2/c9-8(10,11)13-7-4-2-1-3-6(7)5-12/h1-5H
- InChI Key: CPHXLFKIUVVIOQ-UHFFFAOYSA-N
- SMILES: O=CC1C(OC(F)(F)F)=CC=CC=1
- BRN: 6137162
Computed Properties
- Exact Mass: 190.02400
- Monoisotopic Mass: 190.024
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 179
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2.9
- Topological Polar Surface Area: 26.3
Experimental Properties
- Color/Form: liquid
- Density: 1.332?g/mL?at 25?°C(lit.)
- Boiling Point: 76°C/20mmHg(lit.)
- Flash Point: Degrees Fahrenheit:152.6°F
Degrees Celsius:67°C - Refractive Index: n20/D 1.454(lit.)
- PSA: 26.30000
- LogP: 2.39770
- Sensitiveness: Air Sensitive
- Solubility: Not determined
2-(Trifluoromethoxy)benzaldehyde Security Information
-
Symbol:
- Prompt:warning
- Signal Word:Warning
- Hazard Statement: H315,H319,H335
- Warning Statement: P261,P305+P351+P338
- Hazardous Material transportation number:NA 1993 / PGIII
- WGK Germany:3
- Hazard Category Code: 36/37/38
- Safety Instruction: S26-S36
-
Hazardous Material Identification:
- HazardClass:IRRITANT, AIR SENSITIVE
- Risk Phrases:R36/37/38
2-(Trifluoromethoxy)benzaldehyde Customs Data
- HS CODE:2913000090
- Customs Data:
China Customs Code:
2913000090Overview:
2913000090 Item2912Other derivatives of the listed products [refer to halogenation,sulfonation,Nitrosative or nitrosative derivatives]. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%
Declaration elements:
Product Name, component content, use to
Summary:
HS: 2913000090 halogenated, sulphonated, nitrated or nitrosated derivatives of products of heading 2912 Educational tariff:17.0% Tax rebate rate:9.0% Regulatory conditions:none Most favored nation tariff:5.5% General tariff:30.0%
2-(Trifluoromethoxy)benzaldehyde Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 007533-25g |
2-(Trifluoromethoxy)benzaldehyde |
94651-33-9 | 98% | 25g |
£44.00 | 2022-03-01 | |
| Fluorochem | 007533-100g |
2-(Trifluoromethoxy)benzaldehyde |
94651-33-9 | 98% | 100g |
£148.00 | 2022-03-01 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | T123412-25g |
2-(Trifluoromethoxy)benzaldehyde |
94651-33-9 | 96% | 25g |
¥617.90 | 2023-08-31 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | T123412-5g |
2-(Trifluoromethoxy)benzaldehyde |
94651-33-9 | 96% | 5g |
¥164.90 | 2023-08-31 | |
| Chemenu | CM255942-500g |
2-(Trifluoromethoxy)benzaldehyde |
94651-33-9 | 95+% | 500g |
$486 | 2021-06-16 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R010065-25g |
2-(Trifluoromethoxy)benzaldehyde |
94651-33-9 | 96% | 25g |
¥295 | 2024-07-19 | |
| SHANG HAI YI EN HUA XUE JI SHU Co., Ltd. | R010065-5g |
2-(Trifluoromethoxy)benzaldehyde |
94651-33-9 | 96% | 5g |
¥74 | 2024-07-19 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | T67330-5g |
2-(Trifluoromethoxy)benzaldehyde |
94651-33-9 | 97% | 5g |
¥39.0 | 2023-09-06 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | T67330-25g |
2-(Trifluoromethoxy)benzaldehyde |
94651-33-9 | 97% | 25g |
¥185.0 | 2023-09-06 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | T67330-100g |
2-(Trifluoromethoxy)benzaldehyde |
94651-33-9 | 100g |
¥896.0 | 2021-09-07 |
2-(Trifluoromethoxy)benzaldehyde Production Method
Production Method 1
Reaction Conditions
1.1 Reagents: Aluminum chloride Solvents: Benzene ; cooled; rt; overnight, rt
Reference
Production Method 2
Reaction Conditions
Reference
- Preparation of pyrimidine derivatives as modulators of insulin-like growth factor-1 receptor (IGF-1), World Intellectual Property Organization, , ,
Production Method 3
Reaction Conditions
1.1 Catalysts: Ruthenium(2+), tris(4,4′-dimethyl-2,2′-bipyridine-κN1,κN1′)-, (OC-6-11)-, hexafl… Solvents: Acetonitrile ; cooled; 16 h, rt
Reference
- Radical C-H Trifluoromethoxylation of (Hetero)arenes with Bis(trifluoromethyl)peroxideDix, Stefan; Golz, Paul; Schmid, Jonas R. ; Riedel, Sebastian ; Hopkinson, Matthew N., Chemistry - A European Journal, 2021, 27(45), 11554-11558
Production Method 4
Reaction Conditions
1.1 Catalysts: Tris(2,2′-bipyridine)ruthenium(2+) bis(hexafluorophosphate) Solvents: Acetonitrile ; 1 h, rt
Reference
- Photocatalytic trifluoromethoxylation of arenes and heteroarenes in continuous-flowNyuchev, Alexander V. ; Wan, Ting ; Cendon, Borja; Sambiagio, Carlo ; Struijs, Job J. C. ; et al, Beilstein Journal of Organic Chemistry, 2020, 16, 1305-1312
Production Method 5
Reaction Conditions
1.1 Catalysts: Tris(2,2′-bipyridine)ruthenium(2+) bis(hexafluorophosphate) Solvents: Acetonitrile ; 1 h, rt
Reference
- Radical Trifluoromethoxylation of Arenes Triggered by a Visible-Light-Mediated N-O Bond Redox FragmentationJelier, Benson J. ; Tripet, Pascal F. ; Pietrasiak, Ewa; Franzoni, Ivan ; Jeschke, Gunnar ; et al, Angewandte Chemie, 2018, 57(42), 13784-13789
Production Method 6
Reaction Conditions
1.1 Reagents: Potassium carbonate Catalysts: Tris(2,2′-bipyridine)ruthenium(2+) bis(hexafluorophosphate) Solvents: Acetonitrile ; 16 h, rt
Reference
- Photocatalytic preparation of perfluoroalkoxy-substituted arenes and heteroarenes, World Intellectual Property Organization, , ,
Production Method 7
Reaction Conditions
1.1 Reagents: N,N,N′,N′-Tetramethylethylenediamine Solvents: Tetrahydrofuran
1.2 Reagents: sec-Butyllithium Solvents: Cyclohexane
1.3 -
1.2 Reagents: sec-Butyllithium Solvents: Cyclohexane
1.3 -
Reference
- 2-, 3-, and 4-(trifluoromethoxy)phenyllithiums: versatile intermediates offering access to a variety of new organofluorine compoundsCastagnetti, Eva; Schlosser, Manfred, European Journal of Organic Chemistry, 2001, (4), 691-695
Production Method 8
Reaction Conditions
1.1 Reagents: Potassium carbonate Solvents: Acetonitrile ; reflux
Reference
- Preparation of secondary amine compounds as tRNA synthetase inhibitors useful in killing Gram-negative bacteria, World Intellectual Property Organization, , ,
Production Method 9
Reaction Conditions
Reference
- Simultaneous Chirality Sensing of Multiple Amines by 19F NMRZhao, Yanchuan; Swager, Timothy M., Journal of the American Chemical Society, 2015, 137(9), 3221-3224
Production Method 10
Reaction Conditions
Reference
- Intramolecular hydroxycarbene C-H-insertion: the curious case of (o-methoxyphenyl)hydroxycarbeneGerbig, Dennis; Ley, David; Reisenauer, Hans Peter; Schreiner, Peter R., Beilstein Journal of Organic Chemistry, 2010, 6, 1061-1069
Production Method 11
Reaction Conditions
Reference
- Preparation of 3-[(fluoroalkoxy)benzylamino]piperidines and analogs as substance P antagonists, World Intellectual Property Organization, , ,
Production Method 12
Production Method 13
Reaction Conditions
1.1 Reagents: Aluminum chloride Solvents: Benzene ; -78 °C; -78 °C → rt; overnight, rt
1.2 Reagents: Water
1.2 Reagents: Water
Reference
- Preparation of fluoroalkoxybenzylamino derivatives of nitrogen containing heterocycles as substance P receptor antagonists, United States, , ,
2-(Trifluoromethoxy)benzaldehyde Raw materials
- Pyridinium, 4-cyano-1-(trifluoromethoxy)-
- Peroxide,bis(trifluoromethyl)
- 2-Hydroxybenzaldehyde
- N-Propyl-Methyl Piperidinium Bis(trifluoroMethylsulfonyl)Imide
- 1H-Benzotriazolium, 1-methyl-7-nitro-3-(trifluoromethoxy)-5-(trifluoromethyl)-
- 1,1-Dichlorodimethyl ether
- (Trifluoromethoxy)benzene
- Benzaldehyde
- Methane, oxybis[trifluoro-
2-(Trifluoromethoxy)benzaldehyde Preparation Products
2-(Trifluoromethoxy)benzaldehyde Suppliers
Amadis Chemical Company Limited
Gold Member
(CAS:94651-33-9)2-(Trifluoromethoxy)benzaldehyde
Order Number:A11093
Stock Status:in Stock
Quantity:500g
Purity:99%
Pricing Information Last Updated:Thursday, 29 August 2024 20:53
Price ($):675.0
Email:[email protected]
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
(CAS:94651-33-9)2-(三氟甲氧基)苯甲醛
Order Number:LE2890276
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:42
Price ($):discuss personally
Email:[email protected]
2-(Trifluoromethoxy)benzaldehyde Related Literature
-
Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
-
Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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