AG008SDC

1040682-92-5 | methyl 1H-pyrrolo[3,2-c]pyridine-4-carboxylate

AG008SDC

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CAS Number	1040682-92-5
Catalog Number	AG008SDC(AGN-PC-0NLWCM)
Chemical Name	methyl 1H-pyrrolo[3,2-c]pyridine-4-carboxylate
IUPAC Name	methyl 1H-pyrrolo[3,2-c]pyridine-4-carboxylate
InChI	InChI=1S/C9H8N2O2/c1-13-9(12)8-6-2-4-10-7(6)3-5-11-8/h2-5,10H,1H3
InChI Key	VLFGZDBQUVCFJQ-UHFFFAOYSA-N
MDL Number	MFCD09965907
Molecular Formula	C9H8N2O2
Molecular Weight	176.1720
SMILES	COC(=O)C1=C2C=CNC2=CC=N1
Synonyms	Methyl 1H-pyrrolo[3,2-c]pyridine-4-carboxylate, 1040682-92-5, AK-56719, AC1Q43SE, SCHEMBL1655505, CTK6J1281, DTXSID00649817, VLFGZDBQUVCFJQ-UHFFFAOYSA-N, KS-00000IZ6, 0950AA, ANW-72077, FCH878884, MFCD09965907, ZINC14401209, AKOS006310384, CS-W006535, RTR-055102, AJ-64840, DS-15149, AX8188002, DB-029388, TR-055102, FT-0726416, 4-methoxycarbonyl-1H-pyrrolo[3,2-c]pyridine, A-5881, Methyl 1H-pyrrolo[3,2-c]pyridine-4-carboxylate, AldrichCPR, C9H8N2O2, 1H-pyrrolo[3,2-c]pyridin-4-amine,

Complexity	208
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.059g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	176.175g/mol
Monoisotopic Mass	176.059g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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