AG000HHX

1190311-94-4 | 1H-Pyrrolo[3,2-b]pyridine, 6-bromo-3-nitro-

AG000HHX

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CAS Number	1190311-94-4
Catalog Number	AG000HHX(AGN-PC-09RUXY)
Chemical Name	1H-Pyrrolo[3,2-b]pyridine, 6-bromo-3-nitro-
IUPAC Name	6-bromo-3-nitro-1H-pyrrolo[3,2-b]pyridine
InChI	InChI=1S/C7H4BrN3O2/c8-4-1-5-7(10-2-4)6(3-9-5)11(12)13/h1-3,9H
InChI Key	KMWWJYXJPXJLEH-UHFFFAOYSA-N
MDL Number	MFCD12963032
Molecular Formula	C7H4BrN3O2
Molecular Weight	242.0296
SMILES	O=[N+](C1=CNC2=CC(Br)=CN=C21)[O-]
Synonyms	6-Bromo-3-nitro-1H-pyrrolo[3,2-b]pyridine, 1190311-94-4, 6-BROMO-3-NITRO-4-AZAINDOLE, CTK4B1022, DTXSID90696653, ANW-46017, MFCD12963032, ZINC44712912, AKOS015998732, FCH1378831, AK-59545, AS-49485, QC-10556, AB0035076, AX8217085, TX-013282, 4CH-000133, FT-0660881, ST24024290, X9347, Q-9142, 1H-Pyrrolo[3,2-b]pyridine, 6-bromo-3-nitro-, C7H4BrN3O2, CB-3702,

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	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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