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Home > Indoles and Oxindole > 3484-10-4
3484-10-4 | 2-Methyl-4-nitroindole
CAS No: 3484-10-4 Catalog No: AG0039YC MDL No:MFCD09028445
Product Description
Catalog Number:
AG0039YC
Chemical Name:
2-Methyl-4-nitroindole
CAS Number:
3484-10-4
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
MDL Number:
MFCD09028445
IUPAC Name:
2-methyl-4-nitro-1H-indole
InChI:
InChI=1S/C9H8N2O2/c1-6-5-7-8(10-6)3-2-4-9(7)11(12)13/h2-5,10H,1H3
InChI Key:
HCISKOUSZIJNET-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc2c1cc([nH]2)C
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.175g/mol
Monoisotopic Mass:
176.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| [Oligodeoxynucleotides containing substituted 4-nitroindoles: synthesis and study of their DNA duplexes]. | Bioorganicheskaia khimiia 20080101 |
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