AG00GTD2

913835-81-1 | (1-(Tert-Butoxycarbonyl)-7-Methoxy-1H-Indol-2-Yl)Boronic Acid

AG00GTD2

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COA

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CAS Number	913835-81-1
Catalog Number	AG00GTD2(AGN-PC-07138S)
Chemical Name	(1-(Tert-Butoxycarbonyl)-7-Methoxy-1H-Indol-2-Yl)Boronic Acid
IUPAC Name	[7-methoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid
InChI	InChI=1S/C14H18BNO5/c1-14(2,3)21-13(17)16-11(15(18)19)8-9-6-5-7-10(20-4)12(9)16/h5-8,18-19H,1-4H3
InChI Key	JYRDIGLHLIDRNE-UHFFFAOYSA-N
MDL Number	MFCD08689542
Molecular Formula	C14H18BNO5
Molecular Weight	291.1074
SMILES	O(C(C)(C)C)C(N1C(B(O)O)=CC2C=CC=C(C1=2)OC)=O
Synonyms	913835-81-1, 1-BOC-7-methoxyindole-2-boronic acid, (1-(tert-Butoxycarbonyl)-7-methoxy-1H-indol-2-yl)boronic acid, 1-(TERT-BUTOXYCARBONYL)-7-METHOXY-1H-INDOL-2-YLBORONIC ACID, MFCD08689542, 1-tert-Butoxycarbonyl-7-methoxyindole-2-boronic acid, [1-(tert-Butoxycarbonyl)-7-methoxy-1H-indol-2-yl]boronic acid, ACMC-209ra4, SCHEMBL13280504, CTK5G9457, DTXSID60657190, ANW-39626, AKOS015836509, ZINC169745075, RTR-028674, SC-53266, SY023470, 1-Boc-7-methoxy-1H-indole-2-boronic acid, TR-028674, FT-0687797, ST24020071, V9029, MFCD08689542 (95%), A-3826, I04-1902, 7-Methoxy-1H-indole-2-boronic acid, N-BOC protected, 1-(tert-butoxycarbonyl)-7-methoxyindol-2-ylboronic acid, 1-(TERT-BUTOXYCARBONYL)-7-METHOXY-1H-INDOL-2-YLBOR, 1-(tert-Butoxycarbonyl)-7-methoxy-1H-indole-2-boronic acid, {1-[(tert-butoxy)carbonyl]-7-methoxy-1H-indol-2-yl}boronic acid, 1-(tert-Butoxycarbonyl)-7-methoxy-1H-indol-2-ylboronic acid, AldrichCPR, 1H-Indole-1-carboxylicacid,2-borono-7-methoxy-,1-(1,1-dimethylethyl)ester, C14H18BNO5, 1H-Indole-1-carboxylic acid, 2-borono-7-methoxy-, 1-(1,1-dimethylethyl) ester,

Complexity	384
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	291.128g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	291.11g/mol
Monoisotopic Mass	291.128g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	80.9A^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-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

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