2,5,8,11-Tetraoxatridecane-13-thiol

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Catalog Number
ACM52190553
Product Name
2,5,8,11-Tetraoxatridecane-13-thiol
Structure
Structure
CAS
52190-55-3
Category
Heterocyclic Organic Compound
Synonyms
2,5,8,11-TETRAOXATRIDECANE-13-THIOL
IUPAC Name
2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanethiol
Molecular Weight
224.32g/mol
Molecular Formula
C9H20O4S
Canonical SMILES
COCCOCCOCCOCCS
InChI
InChI=1S/C9H20O4S/c1-10-2-3-11-4-5-12-6-7-13-8-9-14/h14H,2-9H2,1H3
InChI Key
VXEBAWYHFQRROQ-UHFFFAOYSA-N
Density
1.035
Complexity
103
Covalently-Bonded Unit Count
1
Exact Mass
224.10823g/mol
Formal Charge
0
H-Bond Acceptor
5
H-Bond Donor
1
Heavy Atom Count
14
Monoisotopic Mass
224.10823g/mol
Rotatable Bond Count
11
XLogP3
-0.1
MSDS
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COA
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Spec Sheet
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