AG001FP5

14098-24-9 | 1,4,7,10,13,16-Benzohexaoxacyclooctadecin, 2,3,5,6,8,9,11,12,14,15-decahydro-

AG001FP5

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CAS Number	14098-24-9
Catalog Number	AG001FP5(AGN-PC-0PQ42P)
Chemical Name	1,4,7,10,13,16-Benzohexaoxacyclooctadecin, 2,3,5,6,8,9,11,12,14,15-decahydro-
IUPAC Name	2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(22),18,20-triene
InChI	InChI=1S/C16H24O6/c1-2-4-16-15(3-1)21-13-11-19-9-7-17-5-6-18-8-10-20-12-14-22-16/h1-4H,5-14H2
InChI Key	DSFHXKRFDFROER-UHFFFAOYSA-N
MDL Number	MFCD00062741
Molecular Formula	C16H24O6
Molecular Weight	312.3582
SMILES	C12=CC=CC=C1OCCOCCOCCOCCOCCO2
Synonyms	Benzo-18-crown-6, 14098-24-9, Benzo-18-crown 6-Ether, MFCD00062741, 2,3,5,6,8,9,11,12,14,15-Decahydrobenzo[b][1,4,7,10,13,16]hexaoxacyclooctadecine, DSFHXKRFDFROER-UHFFFAOYSA-N, AK133008, Benzo-18-crown-6, 97%, 2,3-Benzo-1,4,7,10,13,16-hexaoxaoctadec-2-ene, 2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(22),18,20-triene, b18c6, Monobenzo-18-crown-6, AC1LBNJ2, Benzo-18-crown6-Ether, benzo-18-crown-6 ether, B18C6-benzo crown ether, AC1Q70FV, 2,3-Benzo-18-crown-6, SCHEMBL687476, Benzo-18-crown-6, 98%, CHEMBL493574, Jsp002430, C16H24O6, ZINC4261979, ZX-AT011445, OR9808, AKOS015889751, API0001628, CB-1194, MCULE-2031226230, VZ31289, 1,4,7,10,13,16-Benzohexaoxacyclooctadecin, 2,3,5,6,8,9,11,12,14,15-decahydro-, KS-000016Z9, AJ-49822, SC-25652, AM20020476, FT-0622698, ST50826175, 098B249, C-19312, I01-3148, J-007438, 1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16-hexadecahydrobenzo[a][18]annulene, 2,3,5,6,8,9,11,12,14,15-Decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecine #, Benzo-18-crown-6, 98% 1g, AR-1H7684, CID585779, ZINC04261979, ACN-041825, B1539, 141365-20-0,

Complexity	237
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	312.157g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	312.362g/mol
Monoisotopic Mass	312.157g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	55.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

Lot Number