AG005WD4

959795-70-1 | 4-(4-(4-Methylpiperazin-1-yl)piperidin-1-yl)aniline

AG005WD4

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CAS Number	959795-70-1
Catalog Number	AG005WD4(AGN-PC-0C4UJH)
Chemical Name	4-(4-(4-Methylpiperazin-1-yl)piperidin-1-yl)aniline
IUPAC Name	4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]aniline
InChI	InChI=1S/C16H26N4/c1-18-10-12-20(13-11-18)16-6-8-19(9-7-16)15-4-2-14(17)3-5-15/h2-5,16H,6-13,17H2,1H3
InChI Key	MSPNKVDLRJIFRZ-UHFFFAOYSA-N
MDL Number	MFCD22493476
Molecular Formula	C16H26N4
Molecular Weight	274.4044
SMILES	CN1CCN(CC1)C1CCN(CC1)C1=CC=C(N)C=C1
Synonyms	959795-70-1, 4-(4-(4-Methylpiperazin-1-yl)piperidin-1-yl)aniline, 4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]aniline, 4-[4-(4-METHYL-PIPERAZIN-1-YL)-PIPERIDIN-1-YL]-PHENYLAMINE, 4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]Benzenamine, SCHEMBL156422, CTK8C2061, KS-00000QHM, DTXSID10728627, MSPNKVDLRJIFRZ-UHFFFAOYSA-N, BCP18246, CS-M3637, 6715AC, ANW-67710, MFCD22493476, SC5110, ZINC85223888, SB18264, AK-82266, DS-16549, SC-35606, AJ-127340, AX8236950, TC-156455, FT-0713180, X-1245, 4-[4-(4-Methylpiperazine-1-yl)piperidino]aniline, 4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]anilin, C16H26N4, ACN-046354, 113486-29-6,

Complexity	285
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	274.216g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	274.412g/mol
Monoisotopic Mass	274.216g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	35.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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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