AG002VAD

290367-99-6 | 3-Iodo-5-methoxyindazole

AG002VAD

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CAS Number	290367-99-6
Catalog Number	AG002VAD(AGN-PC-0O8N57)
Chemical Name	3-Iodo-5-methoxyindazole
IUPAC Name	3-iodo-5-methoxy-2H-indazole
InChI	InChI=1S/C8H7IN2O/c1-12-5-2-3-7-6(4-5)8(9)11-10-7/h2-4H,1H3,(H,10,11)
InChI Key	QLWRATLJRVZESA-UHFFFAOYSA-N
MDL Number	MFCD07781661
Molecular Formula	C8H7IN2O
Molecular Weight	274.0584
SMILES	COC1=CC2=C(NN=C2I)C=C1
Synonyms	3-Iodo-5-methoxy-1H-indazole, 290367-99-6, 3-Iodo-5-methoxyindazole, 3-Iodo-5-methoxy (1H)indazole, 1H-INDAZOLE, 3-IODO-5-METHOXY-, 1H-Indazole,3-iodo-5-methoxy-, ACMC-209h6c, 3-iodo-5-methoxy-2H-indazole, SCHEMBL5952020, 3-Iodo-5-methoxy(1H)indazole, CTK4G2621, DTXSID80573166, QLWRATLJRVZESA-UHFFFAOYSA-N, ANW-26530, CI-561, MFCD07781661, ZINC14983635, AKOS015853605, AB42751, FCH1385742, RTR-012707, AJ-66021, AK-92480, AS-40395, CJ-14777, SC-54776, AX8087484, DB-068056, ST2405112, TR-012707, CS-0085359, FT-0768459, V4948, W-2551, I10-911, J-017369, C8H7IN2O,

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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