AG00IICY

945840-82-4 | 1H-Pyrrolo[2,3-c]pyridine-7-carboxylic acid

AG00IICY

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CAS Number	945840-82-4
Catalog Number	AG00IICY(AGN-PC-09RUXQ)
Chemical Name	1H-Pyrrolo[2,3-c]pyridine-7-carboxylic acid
IUPAC Name	1H-pyrrolo[2,3-c]pyridine-7-carboxylic acid
InChI	InChI=1S/C8H6N2O2/c11-8(12)7-6-5(1-3-9-6)2-4-10-7/h1-4,9H,(H,11,12)
InChI Key	XTSUZZHBANMMDD-UHFFFAOYSA-N
MDL Number	MFCD12924374
Molecular Formula	C8H6N2O2
Molecular Weight	162.1454
SMILES	O=C(C1=NC=CC2=C1NC=C2)O
Synonyms	1H-pyrrolo[2,3-c]pyridine-7-carboxylic acid, 945840-82-4, 6-AZAINDOLE-7-CARBOXYLIC ACID, AK119769, CS-WAA0334, SCHEMBL3276660, DTXSID10696650, XTSUZZHBANMMDD-UHFFFAOYSA-N, ZX-RL003491, 6235AC, MFCD12924374, ZINC44713206, AKOS015991377, EG-0703, FCH1185538, MCULE-6859508498, PB19326, QC-2947, KS-000006Q5, BC263990, OR310248, AX8245185, 4CH-000049, ST24038304, Q-3212, C8H6N2O2, ACN-027468,

Complexity	196
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	162.043g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	162.148g/mol
Monoisotopic Mass	162.043g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	66A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

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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