AG009HMP

1211533-09-3 | 5-Cyanopyrazine-2-carboxylic acid

AG009HMP

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CAS Number	1211533-09-3
Catalog Number	AG009HMP(AGN-PC-0J6TLX)
Chemical Name	5-Cyanopyrazine-2-carboxylic acid
IUPAC Name	5-cyanopyrazine-2-carboxylic acid
InChI	InChI=1S/C6H3N3O2/c7-1-4-2-9-5(3-8-4)6(10)11/h2-3H,(H,10,11)
InChI Key	NYZNLFBHQJKDGO-UHFFFAOYSA-N
MDL Number	MFCD22070527
Molecular Formula	C6H3N3O2
Molecular Weight	149.1069
SMILES	O=C(C1=NC=C(C#N)N=C1)O
Synonyms	5-Cyanopyrazine-2-carboxylic acid, 1211533-09-3, SCHEMBL11023993, DTXSID40742139, NYZNLFBHQJKDGO-UHFFFAOYSA-N, 5-cyano-pyrazine-2-carboxylic acid, 2-Pyrazinecarboxylic acid, 5-cyano-, MFCD22070527, ZINC82408714, AKOS022172083, DS-5823, AK137311, AJ-125327, Z2255112615,

Complexity	207
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	149.023g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	149.109g/mol
Monoisotopic Mass	149.023g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	86.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

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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