AG003N74

944937-79-5 | 1H-Pyrrolo[3,2-b]pyridine-6-carbonitrile

AG003N74

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CAS Number	944937-79-5
Catalog Number	AG003N74(AGN-PC-04G0H9)
Chemical Name	1H-Pyrrolo[3,2-b]pyridine-6-carbonitrile
IUPAC Name	1H-pyrrolo[3,2-b]pyridine-6-carbonitrile
InChI	InChI=1S/C8H5N3/c9-4-6-3-8-7(11-5-6)1-2-10-8/h1-3,5,10H
InChI Key	KKJCNVUFINZIBG-UHFFFAOYSA-N
MDL Number	MFCD09763664
Molecular Formula	C8H5N3
Molecular Weight	143.1454
SMILES	N#CC1=CN=C2C(NC=C2)=C1
Synonyms	1H-Pyrrolo[3,2-b]pyridine-6-carbonitrile, 944937-79-5, 6-CYANO-4-AZAINDOLE, AK-59597, PubChem16575, ACMC-209rsc, AC1Q4R4V, SCHEMBL1492236, CTK5H6746, DTXSID40640146, BCP23738, ANW-40282, FCH870365, MFCD09763664, ZINC14401082, AKOS006327358, CC-2215, PB34410, QC-2964, RP20822, RTR-029539, TRA0028840, VP11101, AJ-64803, BC232213, CJ-14512, OR450014, AB0032291, AX8058991, DB-029395, TR-029539, 4CH-000036, 6-CYANO-1H-PYRROLO[3,2-B]PYRIDINE, FT-0656918, ST24038306, X5585, A-6737, A844986, J-518670, S14-1799, 1H-Pyrrolo[3,2-b]pyridine-6-carbonitrile, AldrichCPR, C8H5N3, ACN-027451, 1190322-82-7,

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	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 3439

Certificate of Analysis

Lot Number