AG004DBQ

885519-30-2 | 3-Bromo-5-methoxy-1H-indazole

AG004DBQ

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CAS Number	885519-30-2
Catalog Number	AG004DBQ(AGN-PC-0VME1W)
Chemical Name	3-Bromo-5-methoxy-1H-indazole
IUPAC Name	3-bromo-5-methoxy-2H-indazole
InChI	InChI=1S/C8H7BrN2O/c1-12-5-2-3-7-6(4-5)8(9)11-10-7/h2-4H,1H3,(H,10,11)
InChI Key	HYFXBJKOXIFDNQ-UHFFFAOYSA-N
MDL Number	MFCD07781660
Molecular Formula	C8H7BrN2O
Molecular Weight	227.0580
SMILES	COC1=CC=C2NN=C(Br)C2=C1
Synonyms	3-Bromo-5-methoxy-1H-indazole, 885519-30-2, SCHEMBL2316798, 3-bromo-5-methoxy-2H-indazole, CTK8C0306, DTXSID20646303, 3-Bromo-5-methoxy (1H)indazole, 3-Bromo-5-methoxy-1H -indazole, 1H-Indazole, 3-bromo-5-methoxy-, CS-B1066, KS-00003HI2, ANW-64471, MFCD07781660, ZINC14983634, AKOS016006144, AM81214, AS-8532, MB05005, 1H-INDAZOLE,3-BROMO-5-METHOXY-, AJ-66020, AK103796, SC-54775, AB0081705, DB-058158, TC-153216, FT-0687970, Z2704, C8H7BrN2O, C-1830, 3-Bromo-5-methoxy-1H-indazole, 97% - 1G 1g,

Complexity	167
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	225.974g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	227.061g/mol
Monoisotopic Mass	225.974g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

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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