4-(4-METHYLPIPERAZINE-1-CARBONYL)PHENYLBORONIC ACID, PINACOL ESTER

CAS No.
832114-06-4
CCD No.
CCD00507482
Formula
C18 H27 B N2 O3
MolWeight
330.233

Basic Information

Product Name: 4-(4-METHYLPIPERAZINE-1-CARBONYL)PHENYLBORONIC ACID, PINACOL ESTER
CAS: 832114-06-4
English Synonyms: (4-METHYLPIPERAZIN-1-YL)(4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL)METHANONE ; 4-(4-METHYL-1-PIPERAZINYLCARBONYL)BENZENEBORONIC ACID PINACOL ESTER ; (4-METHYLPIPERAZINE-1-YL)[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]METHANONE ; 4-(4-METHYLPIPERAZINE-1-CARBONYL)PHENYLBORONIC ACID, PINACOL ESTER ; 1-METHYL-4-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZOYL]PIPERAZINE
MDL Number.: MFCD05863914
H bond acceptor: 5
H bond donor: 0
Smile: B1(OC(C(O1)(C)C)(C)C)c2ccc(cc2)C(=O)N3CCN(CC3)C
InChi: InChI=1S/C18H27BN2O3/c1-17(2)18(3,4)24-19(23-17)15-8-6-14(7-9-15)16(22)21-12-10-20(5)11-13-21/h6-9H,10-13H2,1-5H3
InChiKey: InChIKey=TXCDVBDHDQAWLR-UHFFFAOYSA-N

Property

Melting Point: 109-114 DEG C
Comments: WGK: 3

Safety information

Symbol: GHS07 GHS07
Signal word: Warning
Hazard statements: H315-H319-H335
Precautionary statements: P261-P305 + P351 + P338
hazard symbol: Xi
Risk Code: R:36/37/38
Safe Code: S:26
WGK Germany: 3

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