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81171-23-5 | 2-[4-(2-hydroxyethylsulfonyloxy)butoxysulfonyl]ethanol
CAS No: 81171-23-5 Catalog No: AG005FD1 MDL No:
Product Description
Catalog Number:
AG005FD1
Chemical Name:
2-[4-(2-hydroxyethylsulfonyloxy)butoxysulfonyl]ethanol
CAS Number:
81171-23-5
Molecular Formula:
C8H18O8S2
Molecular Weight:
306.3537
IUPAC Name:
4-(2-hydroxyethylsulfonyloxy)butyl 2-hydroxyethanesulfonate
InChI:
InChI=1S/C8H18O8S2/c9-3-7-17(11,12)15-5-1-2-6-16-18(13,14)8-4-10/h9-10H,1-8H2
InChI Key:
ZYHQYSIVGCZMNM-UHFFFAOYSA-N
SMILES:
OCCS(=O)(=O)OCCCCOS(=O)(=O)CCO
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.044g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
306.344g/mol
Monoisotopic Mass:
306.044g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
144A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6
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