AG005WU3

944899-05-2 | Methyl 3-iodo-1H-indazole-7-carboxylate

AG005WU3

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CAS Number	944899-05-2
Catalog Number	AG005WU3(AGN-PC-0WADVM)
Chemical Name	Methyl 3-iodo-1H-indazole-7-carboxylate
IUPAC Name	methyl 3-iodo-2H-indazole-7-carboxylate
InChI	InChI=1S/C9H7IN2O2/c1-14-9(13)6-4-2-3-5-7(6)11-12-8(5)10/h2-4H,1H3,(H,11,12)
InChI Key	BGYFLVURLOZQLU-UHFFFAOYSA-N
MDL Number	MFCD09749943
Molecular Formula	C9H7IN2O2
Molecular Weight	302.0686
SMILES	O=C(C1=CC=CC2=C1NN=C2I)OC
Synonyms	METHYL 3-IODO-1H-INDAZOLE-7-CARBOXYLATE, 944899-05-2, METHYL 3-IODOINDAZOLE-7-CARBOXYLATE, methyl 3-iodo-2H-indazole-7-carboxylate, CTK8B8378, DTXSID30646738, ANW-60241, MFCD09749943, ZINC14986128, AKOS016003181, CM-2191, FCH1393003, PB20377, RP06830, RTC-063546, 3-Iodo-methyl [1]indazole-7-carboxylate, AJ-66520, AS-50626, DA-19327, AX8232913, ST1100737, TC-063546, CS-0049085, FT-0732435, Y5793, C-2026, J-522185, C9H7IN2O2, Methyl3-iodo-1H-indazole-7-carboxylate, methyl 3-iodo-1H-indazole-7-carboxylate, 95% - 1G 1g, 885271-25-0,

Complexity	237
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	301.955g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	302.071g/mol
Monoisotopic Mass	301.955g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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