AG00IB41

62921-76-0 | 2,5,8,11-Tetraoxatridecan-13-ol, 4-methylbenzenesulfonate

AG00IB41

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CAS Number	62921-76-0
Catalog Number	AG00IB41(AGN-PC-0JDK27)
Chemical Name	2,5,8,11-Tetraoxatridecan-13-ol, 4-methylbenzenesulfonate
IUPAC Name	2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate
InChI	InChI=1S/C16H26O7S/c1-15-3-5-16(6-4-15)24(17,18)23-14-13-22-12-11-21-10-9-20-8-7-19-2/h3-6H,7-14H2,1-2H3
InChI Key	CRLOMMYKVYXMLY-UHFFFAOYSA-N
MDL Number	MFCD11041134
Molecular Formula	C16H26O7S
Molecular Weight	362.4384
SMILES	O=S(C1=CC=C(C)C=C1)(OCCOCCOCCOCCOC)=O
Synonyms	2,5,8,11-TETRAOXATRIDECAN-13-YL 4-METHYLBENZENESULFONATE, 62921-76-0, m-PEG5-Tos, MEO-DPEG(4)-TOS, BIPG1653, SCHEMBL2329512, CRLOMMYKVYXMLY-UHFFFAOYSA-N, KM0671, MFCD11041134, ZINC39224165, AKOS030213492, AK689177, BP-20628, 1-(Tosyloxy)-3,6,9,12-tetraoxatridecane, 2,5,8,11-tetraoxatridecan-13-yl-4-methylbenzenesulfonate, toluene-4-sulfonic acid 2-{2-[2-(2-methoxy-ethoxy)-ethoxy]-ethoxy}-ethyl ester,

Complexity	386
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	362.14g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	362.437g/mol
Monoisotopic Mass	362.14g/mol
Rotatable Bond Count	14
Topological Polar Surface Area	88.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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