AG00DAEB

475102-12-6 | (1-(tert-Butoxycarbonyl)-5-chloro-1H-indol-2-yl)boronic acid

AG00DAEB

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	475102-12-6
Catalog Number	AG00DAEB(AGN-PC-0L72FE)
Chemical Name	(1-(tert-Butoxycarbonyl)-5-chloro-1H-indol-2-yl)boronic acid
IUPAC Name	[5-chloro-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid
InChI	InChI=1S/C13H15BClNO4/c1-13(2,3)20-12(17)16-10-5-4-9(15)6-8(10)7-11(16)14(18)19/h4-7,18-19H,1-3H3
InChI Key	AHBMFEBTZKYPED-UHFFFAOYSA-N
MDL Number	MFCD04039005
Molecular Formula	C13H15BClNO4
Molecular Weight	295.5265
SMILES	CC(C)(C)OC(=O)N1C(=CC2=C1C=CC(Cl)=C2)B(O)O
Synonyms	475102-12-6, 1-Boc-5-chloro-1h-indole-2-boronic acid, (1-(tert-Butoxycarbonyl)-5-chloro-1H-indol-2-yl)boronic acid, {1-[(tert-butoxy)carbonyl]-5-chloro-1H-indol-2-yl}boronic acid, 2-BORONO-5-CHLORO-1H-INDOLE-1-CARBOXYLIC ACID 1-(1,1-DIMETHYLETHYL) ESTER, [1-(tert-butoxycarbonyl)-5-chloro-1h-indol-2-yl]boronic acid, PubChem24073, ACMC-1AM86, AC1N5P65, SCHEMBL2930214, CTK4J0053, DTXSID00400743, ANW-30535, MFCD04039005, 1-Boc-5-chloroindole-2-boronic acid, [5-chloro-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic Acid, AKOS004116219, ZINC169743858, AB17237, CB-2275, TR-017516, V6096, (N-Boc-5-chloro-2-indolyl)boronic acid, 95%, A-3801, A827252, I04-1908, 1-(tert-butoxycarbonyl)-5-chloroindol-2-ylboronic acid, N-(tert-Butoxycarbonyl)5-chloro-1H-indole-2-boronic acid, [5-Chloro-1-(tert-butoxycarbonyl)-1H-indole-2-yl]boronic acid, [5-chloranyl-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid, [5-chloro-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-indolyl]boronic acid, C13H15BClNO4, CID4198745, 1H-INDOLE-1-CARBOXYLIC ACID, 2-BORONO-5-CHLORO-, 1-(1,1-DIMETHYLETHYL) ESTER, 1H-Indole-1-carboxylic acid, 2-borono-5-chloro-, 1-(1,1-dimethylethyl) ester (9CI),

Complexity	374
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	295.078g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	295.526g/mol
Monoisotopic Mass	295.078g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	71.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number