AG007ESJ

1072944-98-9 | 1-Boc-Pyrrole-2-Boronic Acid, Pinacol Ester

AG007ESJ

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CAS Number	1072944-98-9
Catalog Number	AG007ESJ(AGN-PC-07XU3F)
Chemical Name	1-Boc-Pyrrole-2-Boronic Acid, Pinacol Ester
IUPAC Name	tert-butyl 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrole-1-carboxylate
InChI	InChI=1S/C15H24BNO4/c1-13(2,3)19-12(18)17-10-8-9-11(17)16-20-14(4,5)15(6,7)21-16/h8-10H,1-7H3
InChI Key	DZQURIUJAGTAFW-UHFFFAOYSA-N
MDL Number	MFCD11504960
Molecular Formula	C15H24BNO4
Molecular Weight	293.1664
SMILES	O=C(N1C(B2OC(C)(C)C(C)(C)O2)=CC=C1)OC(C)(C)C
Synonyms	1072944-98-9, Tert-butyl 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-1-carboxylate, 1-BOC-pyrrole-2-boronic acid, pinacol ester, 1-BOC-pyrrole-2-boronic acid pinacol ester, MFCD11504960, tert-butyl 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrole-1-carboxylate, AK-37157, T-BUTYL 2-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRROLE-1-CARBOXYLATE, DZQURIUJAGTAFW-UHFFFAOYSA-N, PubChem23523, SCHEMBL860007, CTK8B3855, DTXSID00674740, KS-00000HT4, ANW-43327, AKOS016011500, tert-butyl 2-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-1-carboxylate, ZINC169745172, CS-W019105, FCH2838072, PB13405, RTR-001497, BC001106, DS-13183, OR350044, 1-Boc-pyrrloe-2-boronic acid pinacol ester, 1-BOC-pyrrole-2-boronic acid,pinacol ester, AX8161069, TR-001497, 4CH-008648, AM20080028, ST24031725, Z3860, A-3864, J-001762, (1-(TERT-BUTOXYCARBONYL)-1H-PYRROL-2-YL)BORONIC ACID PINACOL ESTER, 2-Methyl-2-propanyl 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-1-carboxylate, C15H24BNO4, ACN-034490, tert-Butyl2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrole-1-carboxylate,

Complexity	400
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	293.18g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	293.17g/mol
Monoisotopic Mass	293.18g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	49.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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