N-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]SUCCINAMIC ACID

CAS No.
480424-98-4
CCD No.
CCD00415875
Formula
C16 H22 B N O5
MolWeight
319.163

Basic Information

Product Name: N-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]SUCCINAMIC ACID
CAS: 480424-98-4
English Synonyms: 4-(3-CARBOXYPROPANAMIDO)PHENYLBORONIC ACID, PINACOL ESTER ; 4-OXO-4-((4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL)AMINO)BUTANOIC ACID ; 4-(SUCCINYLAMINO)PHENYLBORONIC ACID PINACOL ESTER ; 4-(3-CARBOXYPROPIONYLAMINO)PHENYLBORONIC ACID, PINACOL ESTER ; N[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]-SUCCINNAMIC ACID ; N-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]SUCCINAMIC ACID
MDL Number.: MFCD03789267
H bond acceptor: 6
H bond donor: 2
Smile: B1(OC(C(O1)(C)C)(C)C)c2ccc(cc2)NC(=O)CCC(=O)O
InChi: InChI=1S/C16H22BNO5/c1-15(2)16(3,4)23-17(22-15)11-5-7-12(8-6-11)18-13(19)9-10-14(20)21/h5-8H,9-10H2,1-4H3,(H,18,19)(H,20,21)
InChiKey: InChIKey=GZCXOZHMQNWRGM-UHFFFAOYSA-N

Property

Melting Point: 175-178 DEG C(LIT)
Comments: UNSPSC: 12352103
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:26-36
WGK Germany: 3

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