AG000QTM

1260385-93-0 | 1H-Pyrrolo[2,3-b]pyridine-3-carbonitrile, 6-chloro-

AG000QTM

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CAS Number	1260385-93-0
Catalog Number	AG000QTM(AGN-PC-0WD3BJ)
Chemical Name	1H-Pyrrolo[2,3-b]pyridine-3-carbonitrile, 6-chloro-
IUPAC Name	6-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
InChI	InChI=1S/C8H4ClN3/c9-7-2-1-6-5(3-10)4-11-8(6)12-7/h1-2,4H,(H,11,12)
InChI Key	WYLJIMWJDQEDNH-UHFFFAOYSA-N
MDL Number	MFCD18380875
Molecular Formula	C8H4ClN3
Molecular Weight	177.5905
SMILES	N#CC1=CNC2=NC(Cl)=CC=C21
Synonyms	6-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile, 1260385-93-0, 6-Chloro-3-cyano-7-azaindole, DTXSID30856936, MFCD18380875, ZINC95910907, AKOS022173975, FCH1162655, SB14047, KS-000005R8, AS-51296, AJ-135315, AX8260233, CS-0050235, 3-Cyano-6-chloro-1H-pyrrolo[2,3-b]pyridine, 1H-Pyrrolo[2,3-b]pyridine-3-carbonitrile, 6-chloro-,

Complexity	222
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	177.009g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	177.591g/mol
Monoisotopic Mass	177.009g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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