AG00DCMU

52088-10-5 | 3-Iodo-1-methyl-1H-indazole

AG00DCMU

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CAS Number	52088-10-5
Catalog Number	AG00DCMU(AGN-PC-0WB3VJ)
Chemical Name	3-Iodo-1-methyl-1H-indazole
IUPAC Name	3-iodo-1-methylindazole
InChI	InChI=1S/C8H7IN2/c1-11-7-5-3-2-4-6(7)8(9)10-11/h2-5H,1H3
InChI Key	OAQYCAYEBWRHLC-UHFFFAOYSA-N
MDL Number	MFCD09971239
Molecular Formula	C8H7IN2
Molecular Weight	258.0591
SMILES	CN1N=C(I)C2=C1C=CC=C2
Synonyms	3-Iodo-1-methyl-1H-indazole, 52088-10-5, MFCD09971239, 3-iodo-1-methylindazole, SCHEMBL5565026, CTK4J5383, DTXSID90610819, OAQYCAYEBWRHLC-UHFFFAOYSA-N, ZX-CM005826, FCH933334, ZINC19091997, AKOS006338138, PB31461, RP06290, ACM52088105, KS-0000072B, AJ-71732, AK118673, AS-42984, SY037066, CS-0051321, Y9322, MFCD09971239 (95%), Q-1335, J-512677, 4026950-25G, C8H7IN2, 3-iodo-1-methyl-1H-indazole, 95% - 1G 1g, 3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)PROPANOIC ACID HYDROCHLORIDE,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	257.965g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	258.062g/mol
Monoisotopic Mass	257.965g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	17.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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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