AG007HSG

33050-32-7 | 6-Chloro[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one

AG007HSG

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CAS Number	33050-32-7
Catalog Number	AG007HSG(AGN-PC-0LT47I)
Chemical Name	6-Chloro[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one
IUPAC Name	6-chloro-2H-[1,2,4]triazolo[4,3-b]pyridazin-3-one
InChI	InChI=1S/C5H3ClN4O/c6-3-1-2-4-7-8-5(11)10(4)9-3/h1-2H,(H,8,11)
InChI Key	OXXDECZCLRNVKK-UHFFFAOYSA-N
MDL Number	MFCD01219639
Molecular Formula	C5H3ClN4O
Molecular Weight	170.5565
SMILES	O=C1NN=C2C=CC(Cl)=NN21
Synonyms	33050-32-7, 6-chloro[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one, 6-Chloro-[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one, 6-Chloro-1,2,4-triazolo[4,3-b]pyridazin-3(2H)-one, 6-chloro-2H,3H-[1,2,4]triazolo[4,3-b]pyridazin-3-one, 6-chloro-2H-[1,2,4]triazolo[4,3-b]pyridazin-3-one, 1,2,4-Triazolo[4,3-b]pyridazin-3(2H)-one, 6-chloro-, chlorotriazolobpyridazinone, AC1O4JI4, SCHEMBL1243253, CTK4G9837, DTXSID50423341, OXXDECZCLRNVKK-UHFFFAOYSA-N, KS-00001RK1, ZINC2306037, 0386AE, BBL009690, MFCD01219639, SBB088448, STK900146, AKOS005069489, AKOS013059879, MCULE-7959633929, RP10498, TL8007193, TR-013858, CS-0081618, FT-0679994, C-4174, 11D-006, 6-chloro-[1,2,4]-triazolo[4,3-b]pyridazin-3-ol, 6-chloro-[1,2,4]triazolo[4,3-b]pyridazin-3-ol, J-018991, J-518485, 3-hydroxy-6-chloro-1,2,4-triazolo[4,3-b]pyridazine, I14-28675, 1,2,4-Triazolo[4,3-b]pyridazin-3(2H)-one,6-chloro-, 6-chloro-2,3-dihydro-s-triazolo[4,3-b]pyridazin-3-on, 6-chloro-2,3-dihydro-s-triazolo[4,3-b]pyridazin-3-one, 6-chloro-2,3-dihydro-s-triazolo[4,3-b]-pyridazin-3-one, 6-chloro-4-hydro-2H-1,2,4-triazolino[4,3-e]pyridazin-3-one, C5H3ClN4O, ZINC02306037, CID6407182, 6-CHLORO[1,2,4]TRIAZOLO[4,3-B]PYRIDAZIN-3 -ONE,

Complexity	306
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	170g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	170.556g/mol
Monoisotopic Mass	170g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	57.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301-H315-H319-H335-H312+H332
Packing Group	Ⅲ
Precautionary statements	P301+P310-P304+P340-P305+P351+P338-P301+P310-P304+P340-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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