ChemicalBook CAS DataBase List 850568-62-6

850568-62-6

Name	5-BENZYLOXY-1-BOC-INDOLE-2-BORONIC ACID
CAS	850568-62-6
Molecular Formula	C20H22BNO5
MDL Number	MFCD06659824
Molecular Weight	367.2
MOL File	850568-62-6.mol

Synonyms

AKOS BRN-0622 N-BOC-5-BENZYLOXYINDOLE-2-BORONIC ACID 5-BENZYLOXY-1-BOC-2-INDOLEBORONIC ACID 5-BENZYLOXY-1-BOC-INDOLE-2-BORONIC ACID 5-BENZYLOXYINDOLE-2-BORONIC ACID, BOC PROTECTED 5-Benzyloxyindole-2-boronic acid, N-BOC protected 5-BENZYLOXY-1-T-BUTOXYCARBONYLINDOLE-2-BORONIC ACID 5-Benzyloxyindole-2-boronic acid, N-BOC protected 98% 5-Benzyloxy-1H-indole-2-boronic acid, N-BOC protected 5-Benzyloxy-1H-indole-2-boronicacid,N-BOCprotected98% 5-Benzyloxy-1H-indole-2-boronic acid, N-BOC protected 98% 5-(Benzyloxy)-1-(tert-butoxycarbonyl)-1H-indole-2-boronic acid 5-(BENZYLOXY)-1-(TERT-BUTOXYCARBONYL)-1H-INDOL-2-YLBORONIC ACID 1-(tert-butoxycarbonyl)-5-(benzyloxy)-1H-indol-2-yl-2-boronic acid [1-[(2-methylpropan-2-yl)oxy-oxomethyl]-5-phenylmethoxy-2-indolyl]boronic acid 1H-Indole-1-carboxylic acid, 2-borono-5-(phenylmethoxy)-, 1-(1,1-dimethylethyl) ester

Chemical Properties

Melting point	106-110
Boiling point	564.7±60.0 °C(Predicted)
density	1.17±0.1 g/cm3(Predicted)
storage temp.	2-8°C
form	powder
pka	7.97±0.30(Predicted)
color	White
InChI	1S/C20H22BNO5/c1-20(2,3)27-19(23)22-17-10-9-16(11-15(17)12-18(22)21(24)25)26-13-14-7-5-4-6-8-14/h4-12,24-25H,13H2,1-3H3
InChIKey	IQKGFXDPCFAYFP-UHFFFAOYSA-N
SMILES	CC(C)(C)OC(=O)n1c(cc2cc(OCc3ccccc3)ccc12)B(O)O

Safety Data

Symbol(GHS)	GHS07
Signal word	Warning
Hazard statements	H315-H319-H335
Precautionary statements	P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes	Xi
Risk Statements	36 less more
Safety Statements	26 less more
WGK Germany	WGK 3
Hazard Note	Irritant
HS Code	2933299090
Storage Class	11 - Combustible Solids
Hazard Classifications	Eye Irrit. 2

Spectrum Detail

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