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3-Methyl-4-Nitrobenzoic Acid

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3-Methyl-4-Nitrobenzoic Acid / CAS : 3113-71-1

Appearance Light yellow to yellow crystalline powder UN -
HS 29163990 DG Class -
Synonyms 3 Methyl 4 Nitro Benzoic acid; 3-Methyl-4-Nitrobenzenecarboxylic Acid; 3-Methyl-4-Nitrobenzoicacid; 4-Nitro-3-Methylbemzoic Acid; 4-Nitro-3-Methylbenzoic Acid; 3-Methyl-4-Nitro-Benzoesaeure; Methyl-4-Nitrobenzoic; 3-Methyl-4-Nitronbenzoic Acid; 3-Methyl-4-Nitro-Benzoic Acid
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Properties

Summary

Formula
C8H7NO4
Molecular Mass
181.14500
Exact Mass
181.03800
PSA
83.12000
Logp
2.12460
IUPAC
3-methyl-4-nitrobenzoic acid
SMILES
CC1=C(C=CC(=C1)C(=O)O)[N+](=O)[O-]

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates
Agrochemicals > Pesticide Intermediates

Chemical and Physical Properties

Melting Point
216-218 °C(lit.)
Density
1.392 g/cm3
Boiling Point
356 ºC
Flash Point
161.2 ºC
Appearance
Light yellow to yellow crystalline powder
Acidity and Basicity
acidness

Export information

HS Code
29163990
Export Rebate
13%
Risk Code
R36/37/38-20/21/22
Safety Label
Xi,Xn

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