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130727-42-3 | 3,6,9,12-Tetraoxatricosan-1-ol, 23-mercapto-
CAS No: 130727-42-3 Catalog No: AG000UVM MDL No:
Product Description
Catalog Number:
AG000UVM
Chemical Name:
3,6,9,12-Tetraoxatricosan-1-ol, 23-mercapto-
CAS Number:
130727-42-3
Molecular Formula:
C19H40O5S
Molecular Weight:
380.5829
IUPAC Name:
2-[2-[2-[2-(11-sulfanylundecoxy)ethoxy]ethoxy]ethoxy]ethanol
InChI:
InChI=1S/C19H40O5S/c20-10-12-22-14-16-24-18-17-23-15-13-21-11-8-6-4-2-1-3-5-7-9-19-25/h20,25H,1-19H2
InChI Key:
IOBMVUDHPRVCSO-UHFFFAOYSA-N
SMILES:
SCCCCCCCCCCCOCCOCCOCCOCCO
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
380.26g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
380.584g/mol
Monoisotopic Mass:
380.26g/mol
Rotatable Bond Count:
22
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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