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162316-50-9 | Acetic acid, 2-(1,4,8,11-tetrathiacyclotetradec-6-yloxy)-
CAS No: 162316-50-9 Catalog No: AG001SZP MDL No:
Product Description
Catalog Number:
AG001SZP
Chemical Name:
Acetic acid, 2-(1,4,8,11-tetrathiacyclotetradec-6-yloxy)-
CAS Number:
162316-50-9
Molecular Formula:
C12H22O3S4
Molecular Weight:
342.5613
IUPAC Name:
2-(1,4,8,11-tetrathiacyclotetradec-6-yloxy)acetic acid
InChI:
InChI=1S/C12H22O3S4/c13-12(14)8-15-11-9-18-6-4-16-2-1-3-17-5-7-19-10-11/h11H,1-10H2,(H,13,14)
InChI Key:
FIDHVLBJRGCOAB-UHFFFAOYSA-N
SMILES:
OC(=O)COC1CSCCSCCCSCCSC1
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.045g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
342.545g/mol
Monoisotopic Mass:
342.045g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
148A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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