Ethylene glycol bis-p-toluenesulfonate

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Catalog Number
ACM6315522
Product Name
Ethylene glycol bis-p-toluenesulfonate
Structure
Structure
CAS
6315-52-2
Category
Heterocyclic Organic Compound
IUPAC Name
2-(4-methylphenyl)sulfonyloxyethyl 4-methylbenzenesulfonate
Molecular Weight
370.4g/mol
Molecular Formula
C16H18O6S2
Canonical SMILES
CC1=CC=C(C=C1)S(=O)(=O)OCCOS(=O)(=O)C2=CC=C(C=C2)C
InChI
InChI=1S/C16H18O6S2/c1-13-3-7-15(8-4-13)23(17,18)21-11-12-22-24(19,20)16-9-5-14(2)6-10-16/h3-10H,11-12H2,1-2H3
InChI Key
LZIPBJBQQPZLOR-UHFFFAOYSA-N
Complexity
517
Covalently-Bonded Unit Count
1
Exact Mass
370.054481g/mol
Formal Charge
0
H-Bond Acceptor
6
H-Bond Donor
0
Heavy Atom Count
24
Monoisotopic Mass
370.054481g/mol
NSC Number
21094
Rotatable Bond Count
7
XLogP3
2.9
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