3-Nitrophthalic anhydride

3-Nitrophthalic anhydride
  • CAS No.:641-70-3
Other grades of this product :
3-Nitrophthalic anhydride Basic information
Product Name:3-Nitrophthalic anhydride
Synonyms:1,3-Isobenzofurandione, 4-nitro-;1,3-Isobenzofurandione,4-nitro-;3-Isobenzofurandione,4-nitro-1;NSC 4134;3-Nitrophthalic anhydride, synthesis grade;4-Nitrobenzo[c]furan-1,3-dione, 4-Nitro-2-benzofuran-1,3-dione, 4-Nitroisobenzofuran-1,3-dione;3-Nitrophthalic anhydride,97%;Phthalic anhydride, 3-nitro- (6CI,7CI,8CI)
CAS:641-70-3
MF:C8H3NO5
MW:193.11
EINECS:211-373-6
Product Categories:Anhydride Monomers;Monomers;Polymer Science;Carbonyl Compounds;Carboxylic Acid Anhydrides;Organic Building Blocks;Amines;Aromatics;Intermediates;Building Blocks;Carbonyl Compounds;Carboxylic Acid Anhydrides;Chemical Synthesis;Organic Building Blocks;Phthalic Acids, Esters and Derivatives;Dyes intermediates
Mol File:641-70-3.mol
3-Nitrophthalic anhydride Chemical Properties
Melting point 163-165 °C (lit.)
Boiling point 329.3°C (rough estimate)
density 1.6392 (rough estimate)
refractive index 1.4700 (estimate)
storage temp. Store below +30°C.
form Crystalline Powder
color Beige to yellow
Water Solubility MAY DECOMPOSE
Sensitive Moisture Sensitive
BRN 179963
CAS DataBase Reference641-70-3(CAS DataBase Reference)
NIST Chemistry Reference3-Nitrophthalic anhydride(641-70-3)
EPA Substance Registry System1,3-Isobenzofurandione, 4-nitro- (641-70-3)
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-36-37/39
WGK Germany 3
10-21
TSCA Yes
HS Code 29173980
MSDS Information
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3-Nitrophthalic anhydride English
ACROS English
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ALFA English
3-Nitrophthalic anhydride Usage And Synthesis
Chemical PropertiesBeige to yellow crystalline powder
UsesAn intermediate for the synthesis of a benzimidazole PARP inhibitor I (succinate salt) (ABT-472). Reactions with aminoquinazolinones yield phthalimidoquinazolinones.
Uses4-Nitrophthalic Anhydride is an intermediate for the synthesis of the benzimidazole PARP inhibitor I, ABT-472. It reacts with aminoquinazolinones to yield phthalimidoquinazolinones.
Preparation3-Nitrophthalic anhydride can be prepared by heating 3-nitrophthalic acid under various conditions and by the action of acetic anhydride, essentially as in the procedure described. The direct nitration of phthalic anhydride yields 3-nitrophthalic anhydride together with the isomeric 4-nitro compound.
Purification MethodsCrystallise it from *C6H6, *C6H6/pet ether, Me2CO, AcOH, or Ac2O (m 164-165o). Dry it at 100o. [Beilstein 17 III/IV 6149, 17/11 V 266.]

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