3-Nitro-5-(trifluoromethyl)benzoic acid

Base Information Edit

Chemical Name:3-Nitro-5-(trifluoromethyl)benzoic acid
CAS No.:328-80-3
Molecular Formula:C8H4F3NO4
Molecular Weight:235.119
Hs Code.:29163990
European Community (EC) Number:630-023-7
DSSTox Substance ID:DTXSID10346941
Nikkaji Number:J261.109K
Wikidata:Q72496392
ChEMBL ID:CHEMBL2179900
Mol file:328-80-3.mol

Synonyms:3-Nitro-5-(trifluoromethyl)benzoic acid;328-80-3;3-Nitro-5-trifluoromethylbenzoic acid;3-Trifluoromethyl-5-nitrobenzoic Acid;Benzoic acid, 3-nitro-5-(trifluoromethyl)-;MFCD00024509;3-(trifluoromethyl)-5-nitrobenzoic acid;3-Carboxy-5-nitrobenzotrifluoride;SCHEMBL129366;CHEMBL2179900;ODCLHXGXGFBBTA-UHFFFAOYSA-;DTXSID10346941;STR05281;CL8096;5-Trifluoromethyl-3-nitrobenzoic acid;3-nitro-5-trifluormethyl-benzoic acid;AKOS005216892;3-nitro-5(trifluoromethyl)benzoic acid;3-Nitro-5-(trifluoromethyl)benzoicacid;3-Nitro-5-trifluoromethyl benzoic acid;5-nitro-3-trifluoromethyl-benzoic acid;a,a,a-trifluoro-5-nitro-m-toluic acid;AB01441;AC-4003;CS-W010331;3-nitro-5 (trifluoromethyl)benzoic acid;5-nitro-3-(trifluoromethyl)benzoic acid;3-Nitro-5-(trifluoromethyl) benzoic acid;SY024756;AM20060887;FT-0616227;T1344;EN300-114573;Z1476863232

Suppliers and Price of 3-Nitro-5-(trifluoromethyl)benzoic acid

Supply Marketing:Edit

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
3-NITRO-5-(TRIFLUOROMETHYL)BENZOIC ACID
100mg
$ 60.00

TCI Chemical
3-Trifluoromethyl-5-nitrobenzoic Acid
25g
$ 350.00

TCI Chemical
3-Trifluoromethyl-5-nitrobenzoic Acid
1g
$ 33.00

TCI Chemical
3-Trifluoromethyl-5-nitrobenzoic Acid
5g
$ 96.00

SynQuest Laboratories
3-(Trifluoromethyl)-5-nitrobenzoic acid 97%
25 g
$ 58.00

SynQuest Laboratories
3-(Trifluoromethyl)-5-nitrobenzoic acid 97%
5 g
$ 21.00

SynQuest Laboratories
3-(Trifluoromethyl)-5-nitrobenzoic acid 97%
100 g
$ 175.00

Sigma-Aldrich
3-NITRO-5-(TRIFLUOROMETHYL)BENZOIC ACID Aldrich
250mg
$ 144.00

Oakwood
3-NITRO-5-(TRIFLUOROMETHYL)BENZOIC ACID 97%
5g
$ 17.00

Oakwood
3-NITRO-5-(TRIFLUOROMETHYL)BENZOIC ACID 97%
1g
$ 10.00

Total 61 raw suppliers

Chemical Property of 3-Nitro-5-(trifluoromethyl)benzoic acid Edit

Chemical Property:

Vapor Pressure:0.000268mmHg at 25°C
Melting Point:128 °C
Boiling Point:309.86 °C at 760 mmHg
PKA:3.05±0.10(Predicted)
Flash Point:141.198 °C
PSA：83.12000
Density:1.596 g/cm³
LogP:2.83500
Storage Temp.:Sealed in dry,Room Temperature
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:235.00924210
Heavy Atom Count:16
Complexity:299

Purity/Quality:

98% ^*data from raw suppliers

3-NITRO-5-(TRIFLUOROMETHYL)BENZOIC ACID ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36/37/39-60-37

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=C(C=C(C=C1C(F)(F)F)[N+](=O)[O-])C(=O)O

Technology Process of 3-Nitro-5-(trifluoromethyl)benzoic acid

There total 2 articles about 3-Nitro-5-(trifluoromethyl)benzoic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 92.0%