AG003TKE

41024-91-3 | Pentaethylene glycol di(p-toluenesulfonate)

AG003TKE

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CAS Number	41024-91-3
Catalog Number	AG003TKE(AGN-PC-0RPSA6)
Chemical Name	Pentaethylene glycol di(p-toluenesulfonate)
IUPAC Name	2-[2-[2-[2-[2-(4-methylphenyl)sulfonyloxyethoxy]ethoxy]ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate
InChI	InChI=1S/C24H34O10S2/c1-21-3-7-23(8-4-21)35(25,26)33-19-17-31-15-13-29-11-12-30-14-16-32-18-20-34-36(27,28)24-9-5-22(2)6-10-24/h3-10H,11-20H2,1-2H3
InChI Key	BUHGDYPBQWWWQS-UHFFFAOYSA-N
MDL Number	MFCD00012204
Molecular Formula	C24H34O10S2
Molecular Weight	546.6508
NSC Number	625453
SMILES	S(=O)(=O)(OCCOCCOCCOCCOCCOS(=O)(=O)c1ccc(cc1)C)c1ccc(cc1)C
Synonyms	41024-91-3, Pentaethylene glycol di-p-toluenesulfonate, 3,6,9,12-tetraoxatetradecane-1,14-diyl bis(4-methylbenzenesulfonate), Pentaethylene glycol ditosylate, NSC625453, Pentaethylene glycol di(p-toluenesulfonate), MFCD00012204, AK142010, Tos-PEG6-Tos, NSC 625453, AC1L7JQT, AC1Q6YCQ, 3,6,9,12-Tetraoxatetradecane-1,14-diol, bis(4-methylbenzenesulfonate), SCHEMBL478342, BIPG1870, CHEMBL1982940, CTK4I4160, Pentaethylene glycol di-p-tosylate, C24H34O10S2, ZINC73258279, AKOS002312381, CS-W004447, DS-7474, MCULE-2318703766, NSC-625453, RL03585, ACM41024913, BP-21828, NCI60_007855, Pentaethylene glycol d(p-toluenesulfonate), AX8146940, FT-0732710, ST50408914, Y4944, C-45853, Pentaethylene glycol di(p-toluenesulfonate), 95%, J-523877, 3,6,9,12-Tetraoxatetradecane-1,14-diyl ditosylate, I14-57640, 14-(((4-Methylphenyl)sulfonyl)oxy)-3,6,9,12-tetraoxatetradec-1-yl 4-methylbenzenesulfonate, 3,6,9,12-Tetraoxatetradecane-1,14-diol,1,14-bis(4-methylbenzenesulfonate), 2-[2-[2-[2-[2-(4-methylphenyl)sulfonyloxyethoxy]ethoxy]ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate, 2-[2-[2-[2-[2-(p-tolylsulfonyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate, 2-{2-[2-(2-{2-[(4-methylphenyl)sulfonyloxy]ethoxy}ethoxy)ethoxy]ethoxy}ethyl 4 -methylbenzenesulfonate, PENTA DI-P-TOLUENESULFONATE, AR-1E9898, CID361968, ACN-041819, Tetraoxatetradecane-1,14-diol, bis(4-methylbenzenesulfonate, 3,6,9,12,-Tetraoxatetradecane-1,14-diol, bis(4-methylbenzenesulfonate, 41287-78-9,

Complexity	694
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	546.159g/mol
Formal Charge	0
Heavy Atom Count	36
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	546.646g/mol
Monoisotopic Mass	546.159g/mol
Rotatable Bond Count	19
Topological Polar Surface Area	140A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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