CAS 2942-40-7 | 1H-Indazole, 4-nitro- | CAS Number 2942-40-7

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2942-40-7 | 1H-Indazole, 4-nitro-

CAS No: 2942-40-7 Catalog No: AG002YBO MDL No:MFCD00022784

Product Description

Catalog Number:

AG002YBO

Chemical Name:

1H-Indazole, 4-nitro-

CAS Number:

2942-40-7

Molecular Formula:

C7H5N3O2

Molecular Weight:

163.1335

MDL Number:

MFCD00022784

IUPAC Name:

4-nitro-1H-indazole

InChI:

InChI=1S/C7H5N3O2/c11-10(12)7-3-1-2-6-5(7)4-8-9-6/h1-4H,(H,8,9)

InChI Key:

WBTVZVUYPVQEIF-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1cccc2c1cn[nH]2

NSC Number:

96892

Properties

Complexity:

192

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

163.038g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

163.136g/mol

Monoisotopic Mass:

163.038g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4

Literature

Title	Journal
N-(7-Eth-oxy-1H-indazol-4-yl)-4-methyl-benzene-sulfonamide.	Acta crystallographica. Section E, Structure reports online 20110601
Fluorinated indazoles as novel selective inhibitors of nitric oxide synthase (NOS): synthesis and biological evaluation.	Bioorganic & medicinal chemistry 20090901
4-substituted indazoles as new inhibitors of neuronal nitric oxide synthase.	Bioorganic & medicinal chemistry letters 20070601
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Regioisomeric 4-nitroindazole N1- and N2-(beta-D-ribonucleosides).	Acta crystallographica. Section C, Crystal structure communications 20040101
Regioselective synthesis of indazole N1- and N2-(beta-D-ribonucleosides).	Nucleosides, nucleotides & nucleic acids 20040101