AG002JPS

208457-81-2 | 1H-Indazole, 7-methyl-6-nitro-

AG002JPS

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CAS Number	208457-81-2
Catalog Number	AG002JPS(AGN-PC-0A7AF2)
Chemical Name	1H-Indazole, 7-methyl-6-nitro-
IUPAC Name	7-methyl-6-nitro-1H-indazole
InChI	InChI=1S/C8H7N3O2/c1-5-7(11(12)13)3-2-6-4-9-10-8(5)6/h2-4H,1H3,(H,9,10)
InChI Key	YKHCFVZVZBXQBH-UHFFFAOYSA-N
MDL Number	MFCD16620021
Molecular Formula	C8H7N3O2
Molecular Weight	177.1601
SMILES	O=[N+](C1=C(C)C2=C(C=C1)C=NN2)[O-]
Synonyms	7-Methyl-6-nitro-1H-indazole, 208457-81-2, 1H-Indazole, 7-methyl-6-nitro-, AK122891, 7-methyl-6-nitroindazole, SCHEMBL3611124, DTXSID50711871, YKHCFVZVZBXQBH-UHFFFAOYSA-N, CS-D0137, 0661AB, MFCD16620021, ZINC89200463, AKOS016012032, AH-0082, FCH1147551, KS-0000224C, OR310663, SY238183, AJ-128376, AX8247069, MFCD16620021 (95%), X-1237, C8H7N3O2,

Complexity	216
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	177.054g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	177.163g/mol
Monoisotopic Mass	177.054g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	74.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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