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65540-85-4 | Triethylene glycol dibenzenesulfonate
CAS No: 65540-85-4 Catalog No: AG00EKEQ MDL No:
Product Description
Catalog Number:
AG00EKEQ
Chemical Name:
Triethylene glycol dibenzenesulfonate
CAS Number:
65540-85-4
IUPAC Name:
benzenesulfonic acid;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
InChI:
InChI=1S/C6H14O4.2C6H6O3S/c7-1-3-9-5-6-10-4-2-8;2*7-10(8,9)6-4-2-1-3-5-6/h7-8H,1-6H2;2*1-5H,(H,7,8,9)
InChI Key:
PXWVKQRKLCEMDF-UHFFFAOYSA-N
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
466.097g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
466.516g/mol
Monoisotopic Mass:
466.097g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
184A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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