AG008XQG

1082041-59-5 | 5-Iodo-6-methoxy-1H-indazole

AG008XQG

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CAS Number	1082041-59-5
Catalog Number	AG008XQG(AGN-PC-0WD3QQ)
Chemical Name	5-Iodo-6-methoxy-1H-indazole
IUPAC Name	5-iodo-6-methoxy-1H-indazole
InChI	InChI=1S/C8H7IN2O/c1-12-8-3-7-5(2-6(8)9)4-10-11-7/h2-4H,1H3,(H,10,11)
InChI Key	UCPXOCULLMUBQN-UHFFFAOYSA-N
MDL Number	MFCD11007886
Molecular Formula	C8H7IN2O
Molecular Weight	274.0585
SMILES	COC1=CC2=C(C=C1I)C=NN2
Synonyms	5-iodo-6-methoxy-1H-indazole, 1082041-59-5, 1H-Indazole, 5-iodo-6-methoxy-, SCHEMBL1541999, 5-Iodo-6-methoxy (1H)indazole, DTXSID50694610, CI-414, MFCD11007886, ZINC42689686, AKOS022173384, FCH1401204, QC-2923, AK141250, AB0095394, AJ-104697, AX8281441, 4CH-003419, CS-0038302, ST24044808, W-1342,

Complexity	167
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	273.96g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	274.061g/mol
Monoisotopic Mass	273.96g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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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