AG004IT0

883738-38-3 | (4-Methylpiperazin-1-yl)(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methanone

AG004IT0

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CAS Number	883738-38-3
Catalog Number	AG004IT0(AGN-PC-0KKNNO)
Chemical Name	(4-Methylpiperazin-1-yl)(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methanone
IUPAC Name	(4-methylpiperazin-1-yl)-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanone
InChI	InChI=1S/C18H27BN2O3/c1-17(2)18(3,4)24-19(23-17)15-8-6-7-14(13-15)16(22)21-11-9-20(5)10-12-21/h6-8,13H,9-12H2,1-5H3
InChI Key	ZYDMNNQZEUSDGG-UHFFFAOYSA-N
MDL Number	MFCD05864308
Molecular Formula	C18H27BN2O3
Molecular Weight	330.2296
SMILES	O=C(N1CCN(C)CC1)C2=CC=CC(B3OC(C)(C)C(C)(C)O3)=C2
Synonyms	883738-38-3, (4-Methylpiperazin-1-yl)(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methanone, 3-(4-methylpiperazine-1-carbonyl)phenylboronic acid, pinacol ester, 3-(4-Methyl-1-piperazinylcarbonyl)benzeneboronic acid pinacol ester, MFCD05864308, n-(4-methylpiperazine)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)benzamide, [3-(4-Methylpiperazine-1-carbonyl)phenyl]boronic acid pinacol ester, (4-Methylpiperazin-1-yl)[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanone, 3-(4-Methylpiperazine-1-carbonyl)phenylboronic acid, pinacol ester, AldrichCPR, AC1MC1RA, (4-methylpiperazin-1-yl)-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanone, AMTB046, SCHEMBL585882, CTK8B3402, DTXSID00374995, ZYDMNNQZEUSDGG-UHFFFAOYSA-N, ZXBA000186, ZX-RL002588, ANW-42469, AKOS015960072, ZINC169743740, AB22759, AS-2288, RTR-027749, KS-0000229I, OR303416, AX8080247, TR-027749, A-9082, J-510739, 3-(4-Methyl-piperazine-1-carbonyl)phenylboronic acid pinacol ester, 3-(4-methylpiperazine-1-carbonyl)-benzeneboronic acid pinacol ester, 3-(4-methylpiperazine-1-carbonyl)benzeneboronic acid pinacol ester, [3-(4-methylpiperazine-1-carbonyl)phenyl] boronic acid pinacol ester, 1-methyl-4-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzoyl]piperazine, 3-(4-methyl-piperazine-1-carbonyl)-phenylboronic acid, pinacol ester, 1-METHYL-3-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZOYL]PIPERAZINE, 1-methyl-4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoyl]piperazine, N-(4-Methyl-piperazine)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)benzamide, n-(4-methylpiperazine)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide, (4-methyl-piperazin-1-yl)-[3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-methanone, 2-Iodylbenzoic acid, C18H27BN2O3, CID2760029, 3- PHENYLBORONICACID,PINACOLESTER, 95464-05-4,

Complexity	459
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	330.211g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	330.235g/mol
Monoisotopic Mass	330.211g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	42A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H315-H319-H332-H335
Packing Group
Precautionary statements	P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P322-P330-P332+P313-P337+P313-P340-P362-P363-P403-P403+P233-P405-P501
UN Code

Certificate of Analysis

Lot Number