8.00646
4-Nitrobenzoic acid
for synthesis
Synonym(s):
4-Nitrobenzoic acid
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About This Item
Linear Formula:
4-(NO2)C6H4COOH
CAS Number:
Molecular Weight:
167.12
UNSPSC Code:
12352106
EC Index Number:
200-526-2
NACRES:
NA.22
MDL number:
Assay:
≥99.0% (HPLC)
Form:
crystals
Quality Level
assay
≥99.0% (HPLC)
form
crystals
potency
1960 mg/kg LD50, oral (Rat)
pH
3.1 (20 °C, 0.42 g/L in H2O, saturated solution)
mp
239-242 °C
density
1.61 g/cm3 at 20 °C
bulk density
700 kg/m3
storage temp.
2-30°C
SMILES string
[N+](=O)([O-])c1ccc(cc1)C(=O)O
InChI
1S/C7H5NO4/c9-7(10)5-1-3-6(4-2-5)8(11)12/h1-4H,(H,9,10)
InChI key
OTLNPYWUJOZPPA-UHFFFAOYSA-N
Analysis Note
Assay (HPLC, area%): ≥ 99.0 % (a/a)
Melting range (lower value): ≥ 239 °C
Melting range (upper value): ≤ 242 °C
Identity (IR): passes test
Melting range (lower value): ≥ 239 °C
Melting range (upper value): ≤ 242 °C
Identity (IR): passes test
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Warning
Hazard Classifications
Acute Tox. 4 Oral - Carc. 2 - Eye Irrit. 2 - Muta. 2 - Repr. 2 - Skin Irrit. 2
Storage Class
11 - Combustible Solids
wgk
WGK 2
Certificates of Analysis (COA)
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