AG008SD9

1040682-68-5 | 1H-Pyrrolo[3,2-c]pyridine-4-carbonitrile

AG008SD9

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CAS Number	1040682-68-5
Catalog Number	AG008SD9(AGN-PC-0NLWCF)
Chemical Name	1H-Pyrrolo[3,2-c]pyridine-4-carbonitrile
IUPAC Name	1H-pyrrolo[3,2-c]pyridine-4-carbonitrile
InChI	InChI=1S/C8H5N3/c9-5-8-6-1-3-10-7(6)2-4-11-8/h1-4,10H
InChI Key	KURHSTXYMIMHKH-UHFFFAOYSA-N
MDL Number	MFCD09965899
Molecular Formula	C8H5N3
Molecular Weight	143.1454
SMILES	N#CC1=NC=CC2=C1C=CN2
Synonyms	1H-Pyrrolo[3,2-c]pyridine-4-carbonitrile, 1040682-68-5, ACMC-2098aq, AC1Q4R5B, 4-CYANO-5-AZAINDOLE, SCHEMBL143655, CTK7C9267, DTXSID00649812, KURHSTXYMIMHKH-UHFFFAOYSA-N, ANW-15024, MFCD09965899, ZINC14401194, AKOS006310074, ZINC253393428, CC-2191, PB10799, QC-2864, RTR-055100, VP11186, AJ-64835, AK-91655, AS-50691, CJ-14523, 5H-pyrrolo[3,2-c]pyridine-4-carbonitrile, AB0061554, DB-029369, ST2403538, TR-055100, CS-0052490, FT-0657027, Z6728, A-5878, A800890, S14-1656, 1H-Pyrrolo[3,2-c]pyridine-4-carbonitrile, AldrichCPR, Z2230911345, C8H5N3,

Complexity	193
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	143.048g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	143.149g/mol
Monoisotopic Mass	143.048g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H317-H319
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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