AG003D3O

41186-03-2 | 1-(m-Tolyl)piperazine

AG003D3O

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CAS Number	41186-03-2
Catalog Number	AG003D3O(AGN-PC-0JLUBD)
Chemical Name	1-(m-Tolyl)piperazine
EC Number	255-251-0
IUPAC Name	1-(3-methylphenyl)piperazine
InChI	InChI=1S/C11H16N2/c1-10-3-2-4-11(9-10)13-7-5-12-6-8-13/h2-4,9,12H,5-8H2,1H3
InChI Key	JIWHIRLNKIUYSM-UHFFFAOYSA-N
MDL Number	MFCD00040734
Molecular Formula	C11H16N2
Molecular Weight	176.2581
NSC Number	184825
SMILES	Cc1cccc(c1)N2CCNCC2
Synonyms	1-(3-Methylphenyl)piperazine, 41186-03-2, 1-(m-Tolyl)piperazine, 1-m-tolylpiperazine, 1-(3-Methylphenyl)-piperazine, 1-m-Tolyl-piperazine, Piperazine, 1-(3-methylphenyl)-, CHEMBL165175, JIWHIRLNKIUYSM-UHFFFAOYSA-N, (3-methylphenyl)piperazine, 1-(3-Methylphenyl)piperazine, 99%, 4-m-tolylpiperazine, EINECS 255-251-0, 1-m-tolyl-piperzine, 4-m-tolyl-piperazine, 3-methylphenylpiperazine, 3-methyl phenylpiperazine, Maybridge4_000089, ACMC-1AK0R, AC1Q2H5V, AC1Q2H5W, NCIOpen2_003566, SCHEMBL81365, 1-(m-Methylphenyl)piperazine, 4-(3-methylphenyl)piperazine, 1-(3-methyl phenyl)piperazine, 1-(3-methylphenyl) piperazine, AC1L34Q8, CTK4I4375, JIWHIRLNKIUYSM-UHFFFAOYSA-, Piperazine,1-(3-methylphenyl)-, ZINC66066, DTXSID30194108, ALBB-005958, KS-000011UM, 5647AB, ANW-29582, BDBM50001904, MFCD00040734, NSC184825, SBB027338, STK500994, AKOS000101165, FS-1235, MCULE-1229085646, NSC-184825, RL03590, VP70140, IDI1_030671, AJ-10179, BP-10761, DB-024582, TR-016365, FT-0605635, R1690, ST50405818, EN300-23498, 1-(3-Methylphenyl)piperazine, >=97.5% (HPLC), I13-446, J-503165, F2190-0518, InChI=1/C11H16N2/c1-10-3-2-4-11(9-10)13-7-5-12-6-8-13/h2-4,9,12H,5-8H2,1H3, 1- piperazine, Cc1cccc(c1)N2CCNCC2, 1-m-Tolyl-piperazine 2HCl salt, C11H16N2, CID83111, NSC71662, 1-(m-Tolyl)piperazine dihydrochloride, C11-H16-N2, Piperazine, 1-(3-methylphenyl)- (9CI), 1-(3-methylphenyl)piperazine dihydrochloride, A6836, T2260, 1-(3-Methylphenyl)piperazine, 96% - 1G 1g, 1-(3-Methylphenyl)piperazine, 99% - 1G 1g,

Complexity	152
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.131g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	176.263g/mol
Monoisotopic Mass	176.131g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	15.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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