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Home > Indoles and Oxindole > 6960-42-5
6960-42-5 | 7-Nitro-1H-indole
CAS No: 6960-42-5 Catalog No: AG003NGR MDL No:MFCD00005683
Product Description
Catalog Number:
AG003NGR
Chemical Name:
7-Nitro-1H-indole
CAS Number:
6960-42-5
Molecular Formula:
C8H6N2O2
Molecular Weight:
162.1454
MDL Number:
MFCD00005683
IUPAC Name:
7-nitro-1H-indole
InChI:
InChI=1S/C8H6N2O2/c11-10(12)7-3-1-2-6-4-5-9-8(6)7/h1-5,9H
InChI Key:
LZJGQIVWUKFTRD-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc2c1[nH]cc2
NSC Number:
69874
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.043g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
162.148g/mol
Monoisotopic Mass:
162.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Direct functionalization of (un)protected tetrahydroisoquinoline and isochroman under iron and copper catalysis: two metals, two mechanisms. | The Journal of organic chemistry 20111104 |
| A novel role of prostaglandin E2 in neuropathic pain: blockade of microglial migration in the spinal cord. | Glia 20110201 |
| Rapid S-nitrosylation of actin by NO-generating donors and in inflammatory pain model mice. | Molecular pain 20110101 |
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