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Home > Other Building Blocks > 138680-96-3
138680-96-3 | 3,6,9,12-Tetraoxaheptadecan-1-ol, 1-methanesulfonate
CAS No: 138680-96-3 Catalog No: AG0018ZI MDL No:
Product Description
Catalog Number:
AG0018ZI
Chemical Name:
3,6,9,12-Tetraoxaheptadecan-1-ol, 1-methanesulfonate
CAS Number:
138680-96-3
Molecular Formula:
C14H30O7S
Molecular Weight:
342.4488
IUPAC Name:
methanesulfonic acid;2-[2-[2-(2-pentoxyethoxy)ethoxy]ethoxy]ethanol
InChI:
InChI=1S/C13H28O5.CH4O3S/c1-2-3-4-6-15-8-10-17-12-13-18-11-9-16-7-5-14;1-5(2,3)4/h14H,2-13H2,1H3;1H3,(H,2,3,4)
InChI Key:
USZFNUHKYGYMBZ-UHFFFAOYSA-N
SMILES:
CCCCCOCCOCCOCCOCCOS(=O)(=O)C
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.182g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
360.462g/mol
Monoisotopic Mass:
360.182g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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