4-Nitro-2,1,3-benzoselenadiazole

• CAS: 20718-41-6
• Catalog Number: ACM20718416
• Category: Other Products; Alkenes
• Molecular Weight: 228.07
• Molecular Formula: C₆H₃N₃O₂Se
• Synonyms: 4-Nitro-2,1,3-benzoselenadiazole, SBB016587, 4-nitrobenzo[c]1,2,5-selenadiazole, AC1N4V5B, 467235_ALDRICH, PUKFAFPOBCMYAI-UHFFFAOYSA-, MolPort-000-679-710, AKOS000121294, MCULE-7237673909, ST50329647, InChI=1/C6H3N3O2Se/c10-9(11)5-3-1-2-4-6(5)8-12-7-4/h1-3H, 20718-41-6
• IUPAC Name: 4-nitro-2,1,3-benzoselenadiazole
• SMILES: C1=CC2=N[Se]N=C2C(=C1)[N+](=O)[O-]
• InChI Key: PUKFAFPOBCMYAI-UHFFFAOYSA-N
• Boiling Point: 356.3ºC at 760 mmHg
• Melting Point: 221ºC (dec.)(lit.)
• Flash Point: 169.3ºC
• Exact Mass: 228.93900
• Hazard Statements: T,N
• H-Bond Acceptor: 4
• H-Bond Donor: 0
• RIDADR: UN2810 - class 6.1 - PG 3 - EHS - Toxic, liquids, organic, n.o.s., HI: all
• Symbol: GHS02

Custom Q&A

What is the molecular formula of 4-Nitro-2,1,3-benzoselenadiazole?

The molecular formula of 4-Nitro-2,1,3-benzoselenadiazole is C6H3N3O2Se.

What is the molecular weight of 4-Nitro-2,1,3-benzoselenadiazole?

The molecular weight of 4-Nitro-2,1,3-benzoselenadiazole is 228.08 g/mol.

What is the IUPAC name of 4-Nitro-2,1,3-benzoselenadiazole?

The IUPAC name of 4-Nitro-2,1,3-benzoselenadiazole is 4-nitro-2,1,3-benzoselenadiazole.

What is the InChI of 4-Nitro-2,1,3-benzoselenadiazole?

The InChI of 4-Nitro-2,1,3-benzoselenadiazole is InChI=1S/C6H3N3O2Se/c10-9(11)5-3-1-2-4-6(5)8-12-7-4/h1-3H.

What is the InChIKey of 4-Nitro-2,1,3-benzoselenadiazole?

The InChIKey of 4-Nitro-2,1,3-benzoselenadiazole is PUKFAFPOBCMYAI-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Nitro-2,1,3-benzoselenadiazole?

The canonical SMILES of 4-Nitro-2,1,3-benzoselenadiazole is C1=CC2=N[Se]N=C2C(=C1)[N+](=O)[O-].

What is the CAS number of 4-Nitro-2,1,3-benzoselenadiazole?

The CAS number of 4-Nitro-2,1,3-benzoselenadiazole is 20718-41-6.

What is the European Community (EC) number of 4-Nitro-2,1,3-benzoselenadiazole?

The European Community (EC) number of 4-Nitro-2,1,3-benzoselenadiazole is 630-708-0.

What is the DSSTox Substance ID of 4-Nitro-2,1,3-benzoselenadiazole?

The DSSTox Substance ID of 4-Nitro-2,1,3-benzoselenadiazole is DTXSID30400099.

Is 4-Nitro-2,1,3-benzoselenadiazole a canonicalized compound?

Yes, 4-Nitro-2,1,3-benzoselenadiazole is a canonicalized compound according to PubChem.