AG004SW2

861881-02-9 | 4-Iodo-1H-pyrazolo[3,4-b]pyridine

AG004SW2

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CAS Number	861881-02-9
Catalog Number	AG004SW2(AGN-PC-0BXYIA)
Chemical Name	4-Iodo-1H-pyrazolo[3,4-b]pyridine
IUPAC Name	4-iodo-1H-pyrazolo[3,4-b]pyridine
InChI	InChI=1S/C6H4IN3/c7-5-1-2-8-6-4(5)3-9-10-6/h1-3H,(H,8,9,10)
InChI Key	PEHWWSPOLYSDBW-UHFFFAOYSA-N
MDL Number	MFCD08706085
Molecular Formula	C6H4IN3
Molecular Weight	245.0205
SMILES	IC1=CC=NC2=C1C=NN2
Synonyms	4-Iodo-1H-pyrazolo[3,4-b]pyridine, 861881-02-9, 1H-Pyrazolo[3,4-b]pyridine, 4-iodo-, 4-IODO-7-AZA-1H-INDAZOLE, 4-Iodo-2H-pyrazolo[3,4-b]pyridine, 4-iodo-7-azaindazole, SCHEMBL290117, AMOT0015, CTK3C7578, DTXSID10727413, PEHWWSPOLYSDBW-UHFFFAOYSA-N, ZX-RL002144, ANW-64260, MFCD11846314, ZINC80441602, AKOS016006402, 4-iodo-1 H-pyrazolo[3,4-b]pyridine, AM85402, FCH1406263, PB23907, AK104015, AS-32681, BC620496, OR305397, QC-11379, AB0038228, AJ-123868, AX8235554, ST2411480, TC-153005, 4CH-011968, CS-0053820, Y5587, Q-3454, Z-9308, C6H4IN3, 4-iodo-1H-pyrazolo[3,4-b]pyridine, 95% - 1G 1g,

Complexity	130
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	244.945g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	245.023g/mol
Monoisotopic Mass	244.945g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	41.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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