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196061

Sigma-Aldrich

4-Methoxy-3-nitrobenzoic acid

98%

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About This Item

Linear Formula:
CH3OC6H3(NO2)CO2H
CAS Number:
89-41-8
Molecular Weight:
197.14
EC Number:
201-906-0
MDL number:
MFCD00007256
UNSPSC Code:
12352100
PubChem Substance ID:
24851734
NACRES:
NA.22

Quality Level

100

Assay

98%

mp

192-194 °C (lit.)

SMILES string

COc1ccc(cc1[N+]([O-])=O)C(O)=O

InChI

1S/C8H7NO5/c1-14-7-3-2-5(8(10)11)4-6(7)9(12)13/h2-4H,1H3,(H,10,11)

InChI key

ANXBDAFDZSXOPQ-UHFFFAOYSA-N

Related Categories

Application

4-Methoxy-3-nitrobenzoic acid was used in the synthesis of:
  • BIPHEP-1-OMe [BIHEP= (2,2′-bis(diphenylphosphino)biphenyl)], precatalyst for reductive coupling of butadiene to aldehydes
  • aniline mustard analogues, having potential anti-tumor activity

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H302

Precautionary Statements

P264 - P270 - P301 + P312 - P501

Hazard Classifications

Acute Tox. 4 Oral

Storage Class Code

11 - Combustible Solids

WGK

WGK 1

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

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Certificates of Analysis (COA)

Lot/Batch Number
05414LD
08226KY
05217JZ
13523LR
07125JX

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