3-Amino-4-fluorobenzoic acid

Base Information

Chemical Name:3-Amino-4-fluorobenzoic acid
CAS No.:2365-85-7
Molecular Formula:C7H6FNO2
Molecular Weight:155.129
Hs Code.:2922499990
European Community (EC) Number:219-122-2
NSC Number:127014
UNII:REU8GMY5DP
DSSTox Substance ID:DTXSID50178329
Nikkaji Number:J213.222B
Wikidata:Q72437098
Mol file:2365-85-7.mol

Synonyms:3-Amino-4-fluorobenzoic acid;2365-85-7;Benzoic acid, 3-amino-4-fluoro-;REU8GMY5DP;EINECS 219-122-2;MFCD00130055;NSC-127014;3-amino-4-fluoro-benzoic acid;NSC127014;UNII-REU8GMY5DP;SCHEMBL397973;WFSPEVFSRUTRCN-UHFFFAOYSA-;DTXSID50178329;BBL028248;CK1082;STL247958;4-FLUORO-3-AMINOBENZOIC ACID;AKOS001430836;AC-3883;AM61423;CS-W016253;DS-1637;NSC 127014;PS-8864;SB76729;SY009032;3-Amino-4-fluorobenzoic acid, AldrichCPR;BB 0257431;FT-0634225;EN300-29498;W-107389;Z283856672

Suppliers and Price of 3-Amino-4-fluorobenzoic acid

Supply Marketing:

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-Amino-4-fluorobenzoic Acid
100mg
$ 75.00

TCI Chemical
3-Amino-4-fluorobenzoic Acid >97.0%(T)
5g
$ 81.00

SynQuest Laboratories
3-Amino-4-fluorobenzoic acid
25 g
$ 82.00

SynQuest Laboratories
3-Amino-4-fluorobenzoic acid
5 g
$ 29.00

SynQuest Laboratories
3-Amino-4-fluorobenzoic acid
100 g
$ 218.00

Medical Isotopes, Inc.
3-Amino-4-fluorobenzoic Acid 97%
1 g
$ 310.00

Matrix Scientific
3-Amino-4-fluorobenzoic acid 97%
25g
$ 53.00

Matrix Scientific
3-Amino-4-fluorobenzoic acid 97%
100g
$ 147.00

Labseeker
3-Amino-4-fluorobenzoic Acid 98
1kg
$ 2200.00

Crysdot
3-Amino-4-fluorobenzoic Acid 97%
100g
$ 166.00

Total 80 raw suppliers

Chemical Property of 3-Amino-4-fluorobenzoic acid

Chemical Property:

Appearance/Colour:Off-White crystalline solid
Vapor Pressure:574mmHg at 25°C
Melting Point:184 °C
Refractive Index:1.336
Boiling Point:335.5 °C at 760 mmHg
PKA:4.30±0.10(Predicted)
Flash Point:156.7 °C
PSA：63.32000
Density:1.43 g/cm³
LogP:1.68730
Storage Temp.:Keep in dark place,Inert atmosphere,Room temperature
Solubility.:soluble in Methanol
XLogP3:1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:155.03825660
Heavy Atom Count:11
Complexity:163

Purity/Quality:

99% ^*data from raw suppliers

3-Amino-4-fluorobenzoic Acid ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi,Xn
Statements: 22

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C(C=C1C(=O)O)N)F

Technology Process of 3-Amino-4-fluorobenzoic acid

There total 3 articles about 3-Amino-4-fluorobenzoic 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: 97.0%

: 453-71-4
3-nitro-4-fluorobenzoic acid

: 2365-85-7
3-amino-4-fluorobenzoic acid

Guidance literature:: With hydrogen; 5%-palladium/activated carbon; In methanol; for 6h;

Reference yield:

: 456-22-4
4-Fluorobenzoic acid

: 2365-85-7
3-amino-4-fluorobenzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: sulfuric acid; potassium nitrate / 20 °C / Cooling with ice

2: acetic acid; iron / methanol / 4 h / 60 °C / Reflux

With sulfuric acid; iron; acetic acid; potassium nitrate; In methanol;
DOI:10.1021/jo500582c