AG005U4Q

76816-54-1 | 1-Propanone,1-(1-piperazinyl)-

AG005U4Q

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CAS Number	76816-54-1
Catalog Number	AG005U4Q(AGN-PC-0L0VK5)
Chemical Name	1-Propanone,1-(1-piperazinyl)-
IUPAC Name	1-piperazin-1-ylpropan-1-one
InChI	InChI=1S/C7H14N2O/c1-2-7(10)9-5-3-8-4-6-9/h8H,2-6H2,1H3
InChI Key	YEQAMPOYHLICPF-UHFFFAOYSA-N
MDL Number	MFCD04973346
Molecular Formula	C7H14N2O
Molecular Weight	142.1989
SMILES	CCC(N1CCNCC1)=O
Synonyms	76816-54-1, 1-(Piperazin-1-yl)propan-1-one, 1-(Propanoyl)-piperazine, 1-propionylpiperazine, 1-piperazin-1-ylpropan-1-one, Piperazine, 1-(1-oxopropyl)-, 1-Propanone,1-(1-piperazinyl)-, 1-(propionyl)piperazine, 1-(1-piperazinyl)-1-propanone, 1-Propanoylpiperazine, 1-(propanoyl)piperazine, AC1Q2RQG, 1-(Propionyl)-piperazine, 1-piperazinyl-1-propanone, SCHEMBL92508, AC1MZ966, 1 - (Propanoyl) - piperazine, CHEMBL3400584, 1-Piperazin-1-yl-propan-1-one, CTK5E3466, KS-00001NSX, DTXSID20397207, YEQAMPOYHLICPF-UHFFFAOYSA-N, 1-Propanone, 1-(1-piperazinyl)-, ZINC2540620, MFCD04973346, 1-(propanoyl)-piperazine, AldrichCPR, AKOS000133770, MCULE-2802609657, PS-3217, FT-0727790, A838843, 1-Pivaloyl-piperazine, 1- -PIPERAZINE, CID3844375, 1-(Propanoyl)-piperazine, 98% - 1G 1g,

Complexity	119
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	142.111g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	142.202g/mol
Monoisotopic Mass	142.111g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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