AG008X9Y

1187385-53-0 | Hexahydropyrrolo[1,2-a]pyrazin-6(2H)-one hydrochloride

AG008X9Y

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CAS Number	1187385-53-0
Catalog Number	AG008X9Y(AGN-PC-07HASJ)
Chemical Name	Hexahydropyrrolo[1,2-a]pyrazin-6(2H)-one hydrochloride
IUPAC Name	2,3,4,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-6-one;hydrochloride
InChI	InChI=1S/C7H12N2O.ClH/c10-7-2-1-6-5-8-3-4-9(6)7;/h6,8H,1-5H2;1H
InChI Key	ZKMZMDVFKFXHKK-UHFFFAOYSA-N
MDL Number	MFCD08752615
Molecular Formula	C7H13ClN2O
Molecular Weight	176.6439
SMILES	O=C1CCC2CNCCN21.[H]Cl
Synonyms	1187385-53-0, Hexahydropyrrolo[1,2-a]pyrazin-6(2H)-one hydrochloride, octahydropyrrolo[1,2-a]piperazin-6-one hydrochloride, Octahydropyrrolo[1,2-a]piperazin-6-one HCl, Hexahydro-pyrrolo[1,2-a]pyrazin-6-one hydrochloride, SCHEMBL9940935, ZKMZMDVFKFXHKK-UHFFFAOYSA-N, 4139AJ, MFCD08752615, AKOS006239045, SB12634, KS-000004P3, AC-30465, AS-52716, AX8292439, CS-0048776, Z-6173, Hexahydro-pyrrolo1,2-apyrazin-6-one hydrochloride, Hexahydro-pyrrolo[1,2-apyrazin-6-one hydrochloride, hexahydropyrrolo[1,2-a]pyrazin-6(7H)-one hydrochloride, Tetrahydropyrrolo[1,2-a]pyrazin-6(1H,2H,7H)-one hydrochloride, C7H12N2O.HCl,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.072g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	176.644g/mol
Monoisotopic Mass	176.072g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number