AG00DEGL

518987-35-4 | 5-METHYL-3-(1H)INDAZOLE CARBOXALDEHYDE

AG00DEGL

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CAS Number	518987-35-4
Catalog Number	AG00DEGL(AGN-PC-0SBM0M)
Chemical Name	5-METHYL-3-(1H)INDAZOLE CARBOXALDEHYDE
IUPAC Name	5-methyl-2H-indazole-3-carbaldehyde
InChI	InChI=1S/C9H8N2O/c1-6-2-3-8-7(4-6)9(5-12)11-10-8/h2-5H,1H3,(H,10,11)
InChI Key	YANNNIQPHXCXGE-UHFFFAOYSA-N
MDL Number	MFCD07781624
Molecular Formula	C9H8N2O
Molecular Weight	160.1726
SMILES	CC2=CC=C1[NH]N=C(C1=C2)C=O
Synonyms	5-methyl-1H-indazole-3-carbaldehyde, 518987-35-4, 5-methyl-2H-indazole-3-carbaldehyde, 5-methyl-3-(1H)indazole carboxaldehyde, AK-22206, PubChem7823, SCHEMBL5953047, CTK6B6079, DTXSID40625973, ANW-50813, CM-215, FCH833316, MFCD07781624, SBB067526, ZINC14983526, AKOS006230547, 5-methyl-1H-Indazole-3-carboxaldehyde, 5-methyl-2H-indazole-3-carboxaldehyde, RP22341, ACM518987354, AJ-65964, AJ-65965, AN-27984, AS-30677, BR-22206, CJ-14767, EN000314, QC-10686, AB0025245, AX8104760, DB-071438, TR-018469, 4CH-006670, CS-0085361, FT-0655681, ST24033043, W6672, S-3597, 987M354, A828828, I14-3882, J-517724, C9H8N2O, 1H-Indazole-3-carboxaldehyde, 5-methyl- (9CI), N/A,

Complexity	183
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	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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