CAS 96-98-0|4-Methyl-3-nitrobenzoic acid

Introduction:Basic information about CAS 96-98-0|4-Methyl-3-nitrobenzoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name4-Methyl-3-nitrobenzoic acid
CAS Number96-98-0Molecular Weight181.15
Density1.4±0.1 g/cm3Boiling Point351.4±30.0 °C at 760 mmHg
Molecular FormulaC8H7NO4Melting Point187-190 °C(lit.)
MSDSChineseUSAFlash Point159.0±13.0 °C
Symbol
GHS07
Signal WordWarning

Names

Name4-Methyl-3-nitrobenzoic acid
SynonymMore Synonyms

4-Methyl-3-nitrobenzoic acid BiologicalActivity

Description4-Methyl-3-nitrobenzoic acid is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Related CatalogResearch Areas >>Others

Chemical & Physical Properties

Density1.4±0.1 g/cm3
Boiling Point351.4±30.0 °C at 760 mmHg
Melting Point187-190 °C(lit.)
Molecular FormulaC8H7NO4
Molecular Weight181.15
Flash Point159.0±13.0 °C
Exact Mass181.037506
PSA83.12000
LogP2.28
Vapour Pressure0.0±0.8 mmHg at 25°C
Index of Refraction1.601
InChIKeyBBEWSMNRCUXQRF-UHFFFAOYSA-N
SMILESCc1ccc(C(=O)O)cc1[N+](=O)[O-]
Water Solubility<0.1 g/100 mL at 22 ºC

Safety Information

Symbol
GHS07
Signal WordWarning
Hazard StatementsH302
Hazard CodesXn:Harmful
Risk PhrasesR20/21/22;R36/37/38
Safety PhrasesS36/37/39-S26-S22
RIDADRNONH for all modes of transport
WGK Germany1
HS Code2916399090

Customs

HS Code2916399090
Summary2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Articles1

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Three novel 1D lanthanide-carboxylate polymeric complexes: syntheses, crystal structures and magnetic analyses.

Dalton Trans. 42(23) , 8504-11, (2013)

Three novel one-dimensional (1D) lanthanide coordination complexes involving the 4-methyl-3-nitrobenzoic acid (HL) ligand, with the general formulae [Gd(L)3(H2O)(CH3OH)] (1), [Gd(L)3(H2O)2]·(4,4'-bpy)...

Synonyms

3-Nitro-p-toluylsaeure
EINECS 202-549-3
p-Toluic acid,3-nitro
3-Nitro-p-toluic acid
4-Methyl-3-nitrobenzoic acid
Benzoic acid,4-methyl-3-nitro
3-nitro-4-methylbenzoic acid
4-Methyl-3-nitro-benzoesaeure
4-methyl-3-nitrobenzoicacid
Benzoic acid, 4-methyl-3-nitro-
m-Nitro-p-toluic acid
MFCD00007174
3-Nitro-para-toluic acid
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