5-Methyl-6-nitroindazole - CAS 72521-00-7

Catalog:	BB034638
Product Name:	5-Methyl-6-nitroindazole
CAS:	72521-00-7
Synonyms:	5-methyl-6-nitro-1H-indazole; 5-methyl-6-nitro-1H-indazole

Technical Data

Patents

Computed Properties

IUPAC Name:	5-methyl-6-nitro-1H-indazole
Description:	5-Methyl-6-nitroindazole (CAS# 72521-00-7) is a useful research chemical.
Molecular Weight:	177.16
Molecular Formula:	C8H7N3O2
Canonical SMILES:	CC1=C(C=C2C(=C1)C=NN2)[N+](=O)[O-]
InChI:	InChI=1S/C8H7N3O2/c1-5-2-6-4-9-10-7(6)3-8(5)11(12)13/h2-4H,1H3,(H,9,10)
InChI Key:	AZWAXIMNWVYSMP-UHFFFAOYSA-N
Boiling Point:	379.7 °C at 760 mmHg
Density:	1.437 g/cm³
Appearance:	Solid
MDL:	MFCD09026996
LogP:	2.30270

Publication Number	Title	Priority Date
WO-2020215022-A1	Novel compounds and methods of use treating fructose-related disorders or diseases	20190417
CN-110546150-A	Pyrazolyl-containing tricyclic derivatives, preparation method and application thereof	20171019
TW-201917129-A	Triazole derivative containing pyrazolyl, preparation method and application thereof	20171019
WO-2019076336-A1	Triazole derivative containing pyrazolyl, preparation method and application thereof	20171019
EP-3699179-A1	Pyrazolyl-containing tricyclic derivative, preparation method therefor and use thereof	20171019

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Related Functional Groups

Nitrogen Compounds

[1281984-38-0]
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[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[78056-67-4]
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[13021-14-2]
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[916792-07-9]
2-Bromo-4-fluoro-5-methylbenzonitrile
[247077-46-9]
3-Fluoro-6-methyl-2-nitropyridine

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Complexity:	216
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	177.053826475
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	177.053826475
Rotatable Bond Count:	0
Topological Polar Surface Area:	74.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7