Cas no 6453-23-2 (9H-Pyrido[3,4-b]indole, 6-nitro-)
![9H-Pyrido[3,4-b]indole, 6-nitro- structure](https://ossimg.kuujia.com/scimg/6500/6453-23-2x500.png)
6453-23-2 structure
Product Name:9H-Pyrido[3,4-b]indole, 6-nitro-
CAS No:6453-23-2
MF:C11H7N3O2
MW:213.192181825638
CID:423228
PubChem ID:317216
Update Time:2025-04-19
9H-Pyrido[3,4-b]indole, 6-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Pyrido[3,4-b]indole, 6-nitro-
- AKOS016035359
- 6453-23-2
- InChI=1/C11H7N3O2/c15-14(16)7-1-2-10-9(5-7)8-3-4-12-6-11(8)13-10/h1-6,13
- 6-nitro-9H-pyrido[3,4-b]indole
- NSC248002
- DTXSID10311937
- SCHEMBL14253015
- NSC-248002
-
- Inchi： 1S/C11H7N3O2/c15-14(16)7-1-2-10-9(5-7)8-3-4-12-6-11(8)13-10/h1-6,13H
- InChI Key： OMKXGOVZKHGTEL-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=CC2=C(C=1)C1C=CN=CC=1N2)=O
Computed Properties
- Exact Mass: 213.05391
- Monoisotopic Mass: 213.054
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 291
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3
- Topological Polar Surface Area: 74.5?2
Experimental Properties
- PSA: 71.82
9H-Pyrido[3,4-b]indole, 6-nitro- Related Literature
-
Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
-
Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
-
Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
6453-23-2 (9H-Pyrido[3,4-b]indole, 6-nitro-) Related Products
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