3-Nitrophthalic Anhydride

• CAS: 641-70-3
• Catalog Number: ACM-MO-641703
• Category: Polymer/Macromolecule; Anhydride Monomers
• Molecular Weight: 193.11 g/mol
• Molecular Formula: C8H3NO5
• Synonyms: 4-nitroisobenzofuran-1,3-dione; 4-nitro-2-benzofuran-1,3-dione
• Canonical SMILES: [O-][N+](=O)c1cccc2C(=O)OC(=O)c12
• InChI: 1S/C8H3NO5/c10-7-4-2-1-3-5(9(12)13)6(4)8(11)14-7/h1-3H
• InChI Key: ROFZMKDROVBLNY-UHFFFAOYSA-N
• Boiling Point: 411.8 °C
• Melting Point: 163-165 °C (lit.)
• Appearance: Yellow Hygroscopic Powder
• Application: Reactions with aminoquinazolinones yield phthalimidoquinazolinones.
• Assay: 98%
• EC Number: 211-373-6
• Features And Benefits: 1. High quality products; 2. Fast delivery; 3. Additional products can be ordered, please contact us for details
• MDL Number: MFCD00005921
• NACRES: NA.23
• Packaging: Packaging; 5, 25 g in glass bottle
• PubChem ID: 24849643
• Quality Level: 200
• Specific Gravity: 1.687

Custom Q&A

What is the PubChem CID of 3-Nitrophthalic anhydride?

The PubChem CID of 3-Nitrophthalic anhydride is 21631.

What is the molecular formula of 3-Nitrophthalic anhydride?

The molecular formula of 3-Nitrophthalic anhydride is C8H3NO5.

What are the synonyms of 3-Nitrophthalic anhydride?

The synonyms of 3-Nitrophthalic anhydride include 4-nitroisobenzofuran-1,3-dione and 4-Nitro-2-benzofuran-1,3-dione.

What is the molecular weight of 3-Nitrophthalic anhydride?

The molecular weight of 3-Nitrophthalic anhydride is 193.11 g/mol.

When was it created and modified?

It was created on March 26, 2005, and modified on December 2, 2023.

What is the IUPAC Name of 3-Nitrophthalic anhydride?

The IUPAC Name of 3-Nitrophthalic anhydride is 4-nitro-2-benzofuran-1,3-dione.

What is the InChI of 3-Nitrophthalic anhydride?

The InChI of 3-Nitrophthalic anhydride is InChI=1S/C8H3NO5/c10-7-4-2-1-3-5(9(12)13)6(4)8(11)14-7/h1-3H.

What is the InChIKey of 3-Nitrophthalic anhydride?

The InChIKey of 3-Nitrophthalic anhydride is ROFZMKDROVBLNY-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Nitrophthalic anhydride?

The canonical SMILES of 3-Nitrophthalic anhydride is C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)OC2=O.

What is the XLogP3-AA value of 3-Nitrophthalic anhydride?

The XLogP3-AA value of 3-Nitrophthalic anhydride is 1.1.