AG008Z1H

1046079-35-9 | 5-(Piperidin-4-yl)-1,3,4-oxadiazol-2(3H)-one hydrochloride

AG008Z1H

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CAS Number	1046079-35-9
Catalog Number	AG008Z1H(AGN-PC-04UHTF)
Chemical Name	5-(Piperidin-4-yl)-1,3,4-oxadiazol-2(3H)-one hydrochloride
IUPAC Name	5-piperidin-4-yl-3H-1,3,4-oxadiazol-2-one;hydrochloride
InChI	InChI=1S/C7H11N3O2.ClH/c11-7-10-9-6(12-7)5-1-3-8-4-2-5;/h5,8H,1-4H2,(H,10,11);1H
InChI Key	XIYYNNHQVKXBLL-UHFFFAOYSA-N
MDL Number	MFCD11109594
Molecular Formula	C7H12ClN3O2
Molecular Weight	205.6421
SMILES	O=C1OC(C2CCNCC2)=NN1.[H]Cl
Synonyms	5-(Piperidin-4-yl)-1,3,4-oxadiazol-2(3H)-one hydrochloride, 1046079-35-9, 5-(PIPERIDIN-4-YL)-1,3,4-OXADIAZOL-2(3H)-ONE HCL, 5-(piperidin-4-yl)-2,3-dihydro-1,3,4-oxadiazol-2-one hydrochloride, CHEMBL457192, SCHEMBL15415894, SCHEMBL19283902, CTK7H0368, KS-00000QQE, DTXSID50648057, XIYYNNHQVKXBLL-UHFFFAOYSA-N, ANW-70605, MFCD11109594, AKOS016007590, DS-3919, AK108386, AB0069183, TC-159350, 4CH-012114, ST24023788, Z3842, M-9940, 5-(piperidin-4-yl)-1,3,4-oxadiazol-2-ol hydrochloride, Z1741981075, 5-(Piperidin-4-yl)-1,3,4-oxadiazol-2(3H)-one--hydrogen chloride (1/1), C7H12ClN3O2, 5-(Piperidin-4-yl)-1,3,4-oxadiazol-2(3H)-onehydrochloride, 1,3,4-Oxadiazol-2(3H)-one, 5-(4-piperidinyl)-, hydrochloride (1:1),

Complexity	221
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.062g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	205.642g/mol
Monoisotopic Mass	205.062g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	62.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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