AG000HON

1190315-72-0 | 1H-Indazole, 4-bromo-5-nitro-

AG000HON

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CAS Number	1190315-72-0
Catalog Number	AG000HON(AGN-PC-0WBRCJ)
Chemical Name	1H-Indazole, 4-bromo-5-nitro-
IUPAC Name	4-bromo-5-nitro-1H-indazole
InChI	InChI=1S/C7H4BrN3O2/c8-7-4-3-9-10-5(4)1-2-6(7)11(12)13/h1-3H,(H,9,10)
InChI Key	BHTUCPXIMAPXJQ-UHFFFAOYSA-N
MDL Number	MFCD12963526
Molecular Formula	C7H4BrN3O2
Molecular Weight	242.0296
SMILES	O=[N+](C1=C(Br)C2=C(NN=C2)C=C1)[O-]
Synonyms	4-BROMO-5-NITRO-1H-INDAZOLE, 1190315-72-0, 1h-indazole,4-bromo-5-nitro-, 1H-Indazole, 4-bromo-5-nitro-, MFCD12963526, ZINC44713412, AKOS025290147, FCH1378990, PB16536, KS-0000072G, AK172274, AS-50959, Q-1573,

Complexity	220
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	240.949g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	242.032g/mol
Monoisotopic Mass	240.949g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	74.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H320-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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