AG001THR

1628557-06-1 | Hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one hydrochloride

AG001THR

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CAS Number	1628557-06-1
Catalog Number	AG001THR(AGN-PC-0WCJYI)
Chemical Name	Hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one hydrochloride
IUPAC Name	2,3,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-4-one;hydrochloride
InChI	InChI=1S/C7H12N2O.ClH/c10-7-5-8-4-6-2-1-3-9(6)7;/h6,8H,1-5H2;1H
InChI Key	HNXDSXZRXCCQED-UHFFFAOYSA-N
MDL Number	MFCD20278321
Molecular Formula	C7H13ClN2O
Molecular Weight	176.6439
SMILES	Cl[H].O=C1CNCC2CCCN12
Synonyms	Hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one hydrochloride, 1628557-06-1, AK161950, Hexahydropyrrolo[1,2-a]pyrazin-4(1H)-one HCl, Hexahydro-pyrrolo[1,2-a]pyrazin-4-one hydrochloride, SCHEMBL16967078, MFCD20278321, AKOS024464322, DS-7429, AC-30457, ST24047379, Z-7848, Hexahydro-pyrrolo1,2-apyrazin-4-one hydrochloride, Hexahydro-pyrrolo[1,2-apyrazin-4-one hydrochloride, octahydropyrrolo[1,2-a]piperazin-4-one hydrochloride, Pyrrolo[1,2-a]pyrazin-4(1H)-one, hexahydro-, hydrochloride (1:1), 1000577-63-8,

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-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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