AG002DQR

189559-85-1 | Ethanone, 1-(1H-indazol-6-yl)-

AG002DQR

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CAS Number	189559-85-1
Catalog Number	AG002DQR(AGN-PC-07134R)
Chemical Name	Ethanone, 1-(1H-indazol-6-yl)-
IUPAC Name	1-(1H-indazol-6-yl)ethanone
InChI	InChI=1S/C9H8N2O/c1-6(12)7-2-3-8-5-10-11-9(8)4-7/h2-5H,1H3,(H,10,11)
InChI Key	PCVRYEUFVDIBFI-UHFFFAOYSA-N
MDL Number	MFCD11869764
Molecular Formula	C9H8N2O
Molecular Weight	160.1726
SMILES	CC(C1=CC2=C(C=C1)C=NN2)=O
Synonyms	1-(1H-indazol-6-yl)ethanone, 189559-85-1, 6-Acetyl-1H-indazole, 1-(1H-Indazol-6-yl)ethan-1-one, Ethanone, 1-(1H-indazol-6-yl)- (9CI), ETHANONE, 1-(1H-INDAZOL-6-YL)-, J-502853, MFCD11869764, SCHEMBL2933207, CTK5J9706, DTXSID20657111, PCVRYEUFVDIBFI-UHFFFAOYSA-N, BCP23465, KS-00002A9Y, ZX-AT000951, ANW-61496, CI-512, ZINC36533312, AKOS016002913, FCH1184670, OR30886, PB25444, PS-4803, RL02410, ACM189559851, AJ-93173, AK-39573, AN-30459, AB0037985, AX8209000, DB-065696, TC-150241, 4CH-021529, FT-0754669, ST24036987, Y5326, A19618, C-2349, 869A764, C9H8N2O, 1-(1H-indazol-6-yl)ethanone, 95% - 1G 1g,

Complexity	193
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	160.064g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	160.176g/mol
Monoisotopic Mass	160.064g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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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