AG00FA8H

677702-36-2 | 5-NITRO INDAZOLE CARBOXALDEHYDE

AG00FA8H

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CAS Number	677702-36-2
Catalog Number	AG00FA8H(AGN-PC-0OGC92)
Chemical Name	5-NITRO INDAZOLE CARBOXALDEHYDE
IUPAC Name	5-nitro-2H-indazole-3-carbaldehyde
InChI	InChI=1S/C8H5N3O3/c12-4-8-6-3-5(11(13)14)1-2-7(6)9-10-8/h1-4H,(H,9,10)
InChI Key	UVUPPLXBIXJRKD-UHFFFAOYSA-N
MDL Number	MFCD07781436
Molecular Formula	C8H5N3O3
Molecular Weight	191.1436
SMILES	[N+](=O)([O-])C2=CC=C1[NH]N=C(C1=C2)C=O
Synonyms	5-nitro-1H-indazole-3-carbaldehyde, 677702-36-2, 5-Nitro indazole carboxaldehyde, 5-nitro-2H-indazole-3-carbaldehyde, MFCD07781436, AK-22209, 5-nitroindazole-3-aldehyde, SCHEMBL4517580, 3-Formyl-5-nitro-1H-indazole, 5-nitro-indazole-3-carbaldehyde, CTK5C6648, DTXSID90613289, UVUPPLXBIXJRKD-UHFFFAOYSA-N, KS-00000F7U, ZX-AT013537, ANW-50799, FCH857263, SBB091243, ZINC14983545, 5-nitro-2H-indazole-3-carboxaldehyde, AKOS006285922, AB42676, CS-W006574, GS-4281, OR40721, RP25070, RP25071, AJ-65974, AJ-65975, BR-22209, EN000340, AB0026205, AX8104952, DB-073927, TX-011215, 4CH-006687, FT-0763204, ST24033066, W7816, S-3600, A835393, J-517857, C8H5N3O3, 6625-96-3,

Complexity	253
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	191.033g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	191.146g/mol
Monoisotopic Mass	191.033g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	91.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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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