AG000P46

1190309-92-2 | 1H-Pyrrolo[2,3-b]pyridine, 6-chloro-3-nitro-

AG000P46

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CAS Number	1190309-92-2
Catalog Number	AG000P46(AGN-PC-09RUYN)
Chemical Name	1H-Pyrrolo[2,3-b]pyridine, 6-chloro-3-nitro-
IUPAC Name	6-chloro-3-nitro-1H-pyrrolo[2,3-b]pyridine
InChI	InChI=1S/C7H4ClN3O2/c8-6-2-1-4-5(11(12)13)3-9-7(4)10-6/h1-3H,(H,9,10)
InChI Key	LHSQYXDNGXWWTK-UHFFFAOYSA-N
MDL Number	MFCD12962921
Molecular Formula	C7H4ClN3O2
Molecular Weight	197.5786
SMILES	O=[N+]([O-])c1c[nH]c2nc(Cl)ccc12
Synonyms	6-Chloro-3-nitro-1H-pyrrolo[2,3-b]pyridine, 1190309-92-2, 6-CHLORO-3-NITRO-7-AZAINDOLE, CTK8C1249, KS-00000QFW, DTXSID30696657, ANW-66110, MFCD12962921, ZINC44712802, AKOS016004746, CC-2125, DS-2486, FCH1144818, MP-1784, AK-84839, QC-11191, AX8236515, TC-154855, 4CH-000111, CS-0054263, ST24024342, Z3952, 1H-Pyrrolo[2,3-b]pyridine, 6-chloro-3-nitro-, C7H4ClN3O2,

Complexity	220
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.999g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	197.578g/mol
Monoisotopic Mass	196.999g/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-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

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