AG003MFP

757978-33-9 | 5-Bromo-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde

AG003MFP

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CAS Number	757978-33-9
Catalog Number	AG003MFP(AGN-PC-04Q69X)
Chemical Name	5-Bromo-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde
IUPAC Name	5-bromo-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde
InChI	InChI=1S/C8H5BrN2O/c9-6-1-7-5(4-12)2-10-8(7)11-3-6/h1-4H,(H,10,11)
InChI Key	YLZQPOVEHGBMFG-UHFFFAOYSA-N
MDL Number	MFCD09755969
Molecular Formula	C8H5BrN2O
Molecular Weight	225.0421
SMILES	BrC=1C=C2C(=NC1)NC=C2C=O
Synonyms	5-bromo-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde, 757978-33-9, 1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXALDEHYDE, 5-BROMO-, 5-bromo-3-formyl-7-azaindole, AC1Q25BF, SCHEMBL1563587, DTXSID60646923, YLZQPOVEHGBMFG-UHFFFAOYSA-N, KS-000002KT, 5-Bromo-7-azaindole 3-carbaldehyde, ANW-50957, MFCD09755969, ZINC14807884, AKOS015919898, CB-3970, CS-W009115, PB17649, RP27566, AJ-65423, AK-30703, BR-30703, CJ-14627, DS-11317, AB0026596, TX-012114, 4CH-000108, ST24029344, W8297, 5-BROMO-7-AZAINDOLE-3-CARBOXALDEHYDE, S-6702, J-516809, 5-Bromo-1H-pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 5-Bromo-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde, AldrichCPR, C8H5BrN2O,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	223.959g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	225.045g/mol
Monoisotopic Mass	223.959g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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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