AG01BGU1

1351813-02-9 | 6-Bromo-5-nitro-1H-indazole

AG01BGU1

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CAS Number	1351813-02-9
Catalog Number	AG01BGU1(AGN-PC-0WNONJ)
Chemical Name	6-Bromo-5-nitro-1H-indazole
IUPAC Name	6-bromo-5-nitro-1H-indazole
InChI	InChI=1S/C7H4BrN3O2/c8-5-2-6-4(3-9-10-6)1-7(5)11(12)13/h1-3H,(H,9,10)
InChI Key	YZKXPWFCVVSHCK-UHFFFAOYSA-N
MDL Number	MFCD27987808
Molecular Formula	C7H4BrN3O2
Molecular Weight	242.0296
SMILES	O=[N+](C1=CC2=C(NN=C2)C=C1Br)[O-]
Synonyms	6-bromo-5-nitro-1H-indazole, 1351813-02-9, 6-bromo-5-nitro-1H-indazol, 1H-Indazole, 6-bromo-5-nitro-, 6-Bromo-5-nitro indazole, SCHEMBL16751174, KS-00000LNU, MFCD27987808, ZINC89197076, AKOS026744931, SB16277, A1-07893,

Complexity	220
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	240.949g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	242.032g/mol
Monoisotopic Mass	240.949g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	74.5A^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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