AG003DSO

368879-17-8 | 1-[(4-Bromophenyl)methyl]-4-methylpiperazine

AG003DSO

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CAS Number	368879-17-8
Catalog Number	AG003DSO(AGN-PC-03LVYI)
Chemical Name	1-[(4-Bromophenyl)methyl]-4-methylpiperazine
IUPAC Name	1-[(4-bromophenyl)methyl]-4-methylpiperazine
InChI	InChI=1S/C12H17BrN2/c1-14-6-8-15(9-7-14)10-11-2-4-12(13)5-3-11/h2-5H,6-10H2,1H3
InChI Key	CXAOXDKQUDHTBK-UHFFFAOYSA-N
MDL Number	MFCD32012268
Molecular Formula	C12H17BrN2
Molecular Weight	269.1808
SMILES	CN1CCN(CC2=CC=C(Br)C=C2)CC1
Synonyms	368879-17-8, 1-(4-BROMOBENZYL)-4-METHYLPIPERAZINE, 1-[(4-Bromophenyl)methyl]-4-methylpiperazine, 1-(4-Bromo-benzyl)-4-methyl-piperazine, ACMC-1AIV9, SCHEMBL578497, CTK4H7346, DTXSID00623394, CXAOXDKQUDHTBK-UHFFFAOYSA-N, ANW-28516, MFCD00811183, ZINC23253598, 1-(4-bromobenzyl)-4-methylpiperzine, AKOS003974328, AB07345, AM90092, MCULE-4030855779, RTR-015039, AJ-81705, AS-17976, 1-(4-Bromophenyl)methyl-4-methylpiperazine, TR-015039, V5538, VU0494724-1, C-1257, Piperazine,1-[(4-bromophenyl)methyl]-4-methyl-, 1-(4-Bromobenzyl)-4-methylpiperazine, AldrichCPR, I13-362, Piperazine, 1-[(4-bromophenyl)methyl]-4-methyl-, F2145-0364, C12H17BrN2,

Complexity	182
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	268.058g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	269.186g/mol
Monoisotopic Mass	268.058g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	6.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
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