AG000N77

1251023-52-5 | 2H-Indazole-3-carboxaldehyde, 5-bromo-2-methyl-

AG000N77

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CAS Number	1251023-52-5
Catalog Number	AG000N77(AGN-PC-0WAB52)
Chemical Name	2H-Indazole-3-carboxaldehyde, 5-bromo-2-methyl-
IUPAC Name	5-bromo-2-methylindazole-3-carbaldehyde
InChI	InChI=1S/C9H7BrN2O/c1-12-9(5-13)7-4-6(10)2-3-8(7)11-12/h2-5H,1H3
InChI Key	LCFUFGSPCPOBCI-UHFFFAOYSA-N
MDL Number	MFCD11520882
Molecular Formula	C9H7BrN2O
Molecular Weight	239.0687
SMILES	BrC2=CC1=C([N](N=C1C=C2)C)C=O
Synonyms	5-Bromo-2-methyl-2H-indazole-3-carbaldehyde, 1251023-52-5, 5-bromo-2-methylindazole-3-carbaldehyde, AK-26851, SCHEMBL18306138, CTK4B4230, DTXSID60718275, KS-000005BH, ANW-50935, MFCD11520882, ZINC59269032, AKOS015835927, FCH1404498, GS-4292, BR-26851, AB0035306, AJ-113399, AX8167713, TR-035074, 4CH-009189, CS-0050615, ST24029376, X9614, S-7421, 2H-Indazole-3-carboxaldehyde, 5-bromo-2-methyl-, 5-Bromo-2-methyl-2H-indazole-3-carbaldehyde, AldrichCPR, C9H7BrN2O, 5bromo2methyl2hindazole3carbaldehyde,

Complexity	212
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	237.974g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	239.072g/mol
Monoisotopic Mass	237.974g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	34.9A^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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