AG007ORF

21943-14-6 | 3-Amino-6-bromopyrazin-2(1H)-one

AG007ORF

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CAS Number	21943-14-6
Catalog Number	AG007ORF(AGN-PC-09RW5K)
Chemical Name	3-Amino-6-bromopyrazin-2(1H)-one
IUPAC Name	3-amino-6-bromo-1H-pyrazin-2-one
InChI	InChI=1S/C4H4BrN3O/c5-2-1-7-3(6)4(9)8-2/h1H,(H2,6,7)(H,8,9)
InChI Key	AVYHXGVOSTVAKN-UHFFFAOYSA-N
MDL Number	MFCD00275443
Molecular Formula	C4H4BrN3O
Molecular Weight	189.9981
SMILES	O=C1C(N)=NC=C(Br)N1
Synonyms	3-AMINO-6-BROMOPYRAZIN-2(1H)-ONE, 21943-14-6, 2(1H)-Pyrazinone, 3-amino-6-bromo-, AK137304, CTK0J9705, KS-00000RPR, DTXSID90696875, 3-amino-6-bromo-1H-pyrazin-2-one, MFCD00275443, ZINC71610483, AKOS022172298, CA-1706, DS-5821, FCH1411366, 3-azanyl-6-bromanyl-1H-pyrazin-2-one, ACM21943146, AJ-118251, AX8258872, 4CH-017241, CS-0042789, A815770,

Complexity	208
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.954g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	190g/mol
Monoisotopic Mass	188.954g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	67.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.4

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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