AG00BYXZ

394223-03-1 | 1H-Pyrrolo[2,3-b]pyridine-2-carboxaldehyde (9CI)

AG00BYXZ

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CAS Number	394223-03-1
Catalog Number	AG00BYXZ(AGN-PC-03H0I4)
Chemical Name	1H-Pyrrolo[2,3-b]pyridine-2-carboxaldehyde (9CI)
IUPAC Name	1H-pyrrolo[2,3-b]pyridine-2-carbaldehyde
InChI	InChI=1S/C8H6N2O/c11-5-7-4-6-2-1-3-9-8(6)10-7/h1-5H,(H,9,10)
InChI Key	ATTNRYFIYJHUOG-UHFFFAOYSA-N
MDL Number	MFCD08437634
Molecular Formula	C8H6N2O
Molecular Weight	146.1460
SMILES	N1C(=CC=2C1=NC=CC2)C=O
Synonyms	1H-pyrrolo[2,3-b]pyridine-2-carbaldehyde, 394223-03-1, 1H-Pyrrolo[2,3-b]pyridine-2-carboxaldehyde, 7-azaindole-2-carboxaldehyde, 1H-Pyrrolo[2,3-b]pyridine-2-carboxaldehyde (9CI), J-504760, 7-Azaindole-2-carboxyaldehyde, SCHEMBL858191, CTK1C1475, DTXSID20619198, ATTNRYFIYJHUOG-UHFFFAOYSA-N, 7-AZAINDOLE-2-CARBALDEHYDE, ANW-63789, CA-115, FCH859461, MFCD08437634, ZINC34924683, AKOS005214162, PB25041, QC-3425, RP01484, AJ-90302, AK-68665, AN-28474, AS-42053, SC-68009, AB0041255, AX8024595, TC-152534, 4CH-024026, AM20051145, CS-0003988, FT-0652010, ST24038300, Y8980, KS-00000378, C-8606, 223P031, A824542, S14-1741, 1H-Pyrrolo[2,3-b]pyridine-2-carbaldehyde, AldrichCPR, C8H6N2O,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	146.048g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	146.149g/mol
Monoisotopic Mass	146.048g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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