AG003KQX

60835-71-4 | 4'-Aminobenzo-15-crown-5-ether

AG003KQX

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CAS Number	60835-71-4
Catalog Number	AG003KQX(AGN-PC-0SXWH4)
Chemical Name	4'-Aminobenzo-15-crown-5-ether
IUPAC Name	2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-amine
InChI	InChI=1S/C14H21NO5/c15-12-1-2-13-14(11-12)20-10-8-18-6-4-16-3-5-17-7-9-19-13/h1-2,11H,3-10,15H2
InChI Key	CQNGAZMLFIMLQN-UHFFFAOYSA-N
MDL Number	MFCD00068686
Molecular Formula	C14H21NO5
Molecular Weight	283.3202
SMILES	NC1=CC=C2OCCOCCOCCOCCOC2=C1
Synonyms	4'-aminobenzo-15-crown-5, 60835-71-4, 4'-Aminobenzo-15-crown-5-ether, 4'-Aminobenzo-15-crown 5-Ether, 4'-Aminobenzo-15-crown-5, 4-Aminobenzo-15-crown 5-ether, 4-Aminobenzo-15-crown-5, 2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-amine, 2,3-(4'-Aminobenzo)-1,4,7,10,13-pentaxoacyclopentadec-2-ene, 2,3,5,6,8,9,11,12-OCTAHYDROBENZO[B][1,4,7,10,13]PENTAOXACYCLOPENTADECIN-15-AMINE, 2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-amine, AC1MC5OT, SCHEMBL1247271, CTK8B3745, 4\'-Aminobenzo-15-crown-5-ether, ZINC3877686, ZX-AT022767, ANW-43082, MFCD00068686, STK391786, 4'-Aminobenzo-15-crown-5, 97%, AKOS001586387, MCULE-6089042156, OR10926, VZ22176, VZ28295, AJ-46494, AN-33544, AN-39381, S587, SC-28238, ST023725, TR-020971, AM20040840, FT-0617554, 835A714, A802287, A832915, C-17831, I14-6238, I14-6719, BRD-K02163413-001-01-8, 2,3-(4-Aminobenzo)-1,4,7,10,13-pentaoxacyclopentadec-2-ene, 1,2,3,4,5,6,7,8,9,10,11,12,13-tridecahydrobenzo[a][15]annulene-15-ylamine, 2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-ami ne, 2,3,5,6,8,9,11,12-OCTAHYDRO-1,4,7,10,13-BENZOPENTAOXOCYCLOPENTADECIN-15-AMINE HYDROCHLORIDE;4'-AMINOBENZO-15-CROWN-5 HYDROCHLORIDE;4-AMINOBENZO-15-CROWN-5 HYDROCHLORIDE;4-aminobenzo-15-crown-5HCl;4-AMINOBENZO-15-CROWN-5 HYDROCHLORIDE 98%;4-Aminobenzo-15-crown-5 hydrochloride,98%, C14H21NO5, ZINC03877686, 4-Aminobenzo-15-crown-5 hydrochloride, CID2724797, A1404, 4'-Aminobenzo-15-crown 5-ether, 97% - 250MG 250mg, 111076-66-5,

Complexity	254
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	283.142g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	283.324g/mol
Monoisotopic Mass	283.142g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	72.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

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

Lot Number