3-Nitrophthalic acid

3-Nitrophthalic acid Basic information
Uses
Product Name:3-Nitrophthalic acid
Synonyms:3-Nitrophthalic acid 96%;3-nitrophthalic;m-Nitrophthalic acid;Phthalic acid, 3-nitro-;LABOTEST-BB LT01689746;AKOS B028734;m-Nitro Phthalic Acid 3-Nitro Phthalic Acid;3-NitrophthalicAcid,>99%
CAS:603-11-2
MF:C8H5NO6
MW:211.13
EINECS:210-030-8
Product Categories:1;intermediate;C8;Carbonyl Compounds;Carboxylic Acids;Aromatics;Phthalic Acids, Esters and Derivatives;Organics;Organic acids;Dyes intermediates;603-11-2
Mol File:603-11-2.mol
3-Nitrophthalic acid Structure
3-Nitrophthalic acid Chemical Properties
Melting point 210 °C (dec.) (lit.)
Boiling point 350.79°C (rough estimate)
density 1.6342 (rough estimate)
vapor density 7.3 (vs air)
refractive index 1.5282 (estimate)
storage temp. Store below +30°C.
solubility water: soluble5%, clear to slightly hazy, colorless to faint yellow or tan
pkapK1:1.88 (25°C)
form Powder
color Off-white to light yellow
Water Solubility 20 g/L (25 ºC)
Decomposition 216 °C
BRN 2054269
Stability:Stable. Incompatible with strong oxidizing agents.
InChIKeyKFIRODWJCYBBHY-UHFFFAOYSA-N
CAS DataBase Reference603-11-2(CAS DataBase Reference)
NIST Chemistry Reference3-Nitrophthalic acid(603-11-2)
EPA Substance Registry System3-Nitrophthalic acid (603-11-2)
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38-41
Safety Statements 26-36/39-37/39-36
WGK Germany 3
Hazard Note Irritant
TSCA Yes
HS Code 29173980
MSDS Information
ProviderLanguage
3-Nitro-1,2-benzenedicarboxylic acid English
SigmaAldrich English
ACROS English
ALFA English
3-Nitrophthalic acid Usage And Synthesis
Uses3-Nitrophthalic Acid is a useful chemical in organic synthesis. It is also an impurity of Apremilast.
Chemical Propertiespale yellow crystals
Uses3-Nitrophthalic acid may be used as starting reagent in the synthesis of modified 2-iodoxybenzoic acid derivatives. It may be used in the synthesis of brucinium 2-carboxy-6-nitrophthalate dihydrate (systematic name: 2,3-dimethoxy-10-oxostrychnidinium 2-carboxy-6-nitrophthalate dihydrate), via heating with brucine.
Uses3-Nitrophthalic Acid is a useful chemical in organic synthesis. It is also an impurity of Apremilast.
Synthesis Reference(s)The Journal of Organic Chemistry, 39, p. 2468, 1974 DOI: 10.1021/jo00930a051
General Description3-Nitrophthalic acid is a degradation product of isoxaben herbicide. It acts as ligand and forms rare-earth complexes.
Safety ProfileA preparative hazard. When heated to decomposition it emits toxic fumes of NOx.
Purification MethodsCrystallise 3-nitrophthalic acid from hot water (1.5mL/g). Dry it in air. The amide has m 201o (from EtOH). [Beilstein 9 H 823, 9 IV 3275.]
4-NITROPHTHALIC ACID pure,4-NITROPHTHALIC ACID TECH. 80%,4-NITROPHTHALIC ACID GRADE II,5-NITROPHTHALIC ACID,4-NITROPHTHALIC ACID 1-Methyl-3-nitrophthalate 2-Nitrocinnamic acid NITROGEN DIOXIDE 3,4-DINITRO-1,2-BENZENEDICARBOXYLIC ACID Ethyl 2-(Chlorosulfonyl)acetate Ascoric Acid Isophthalic acid Diethyl phthalate p-Nitrobenzoic acid 3-Nitrophthalic acid TRITON Nitrobenzene 3-NITROPHTHALIC ACID DIMETHYL ESTER 3-Nitrochlorobenzene Dimethyl phthalate 2-Nitrobenzoic acid 1,3-Dinitrobenzene

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