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2-Methoxyethyl 2-sulfanylacetate

CAT: 0926-UAA78848-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0926-UAA78848-01Size:250 mg
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CAS Number
19788-48-8
MDL Number
MFCD00046839
Smiles
COCCOC (=O) CS
Molecular Formula
C5H10O3S
Molecular Weight
150.2 g/mol
Controlled
No

Chemical Information

Methoxyethyl thioglycolate
CAS Number19788-48-8
PubChem CID542261
IUPAC Name2-methoxyethyl 2-sulfanylacetate
Molecular FormulaC5H10O3S
Molecular Weight150.20
XLogP0.3
Topological Polar Surface Area36.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count9
Formal Charge0
Complexity84
SMILES
COCCOC(=O)CS
InChI
InChI=1S/C5H10O3S/c1-7-2-3-8-5(6)4-9/h9H,2-4H2,1H3
InChIKey
WXYOMNAKWIRZST-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methoxyethyl thioglycolate
CAS: 19788-48-8
CID: 542261
Formula: C5H10O3S
MW: 150.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight150.20
XLogP30.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass150.03506535
Monoisotopic Mass150.03506535
Topological Polar Surface Area36.5 Ų
Heavy Atom Count9
Formal Charge0
Complexity84.3
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes