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Hydroxyethyl disulfide

CAT: 0931-T201769-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T201769-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1892-29-1
Target
Others
Related Pathways
Others
Bioactivity
Hydroxyethyl disulfide can counteract the inhibitory effects of showdomycin on methotrexate-resistant thymidylate synthase and is protected from deactivation by its substrate, deoxyuridine monophosphate, thus preserving the antibiotic's activity.
Smiles
OCCSSCCO
Molecular Formula
C4H10O2S2
Molecular Weight
154.25
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Hydroxyethyl disulfide

2,2'-dithiodiethanol is an organic disulfide.

CAS Number1892-29-1
PubChem CID15906
IUPAC Name2-(2-hydroxyethyldisulfanyl)ethanol
Molecular FormulaC4H10O2S2
Molecular Weight154.3
XLogP-0.5
Topological Polar Surface Area91.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count8
Formal Charge0
Complexity37
SMILES
C(CSSCCO)O
InChI
InChI=1S/C4H10O2S2/c5-1-3-7-8-4-2-6/h5-6H,1-4H2
InChIKey
KYNFOMQIXZUKRK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hydroxyethyl disulfide
CAS: 1892-29-1
CID: 15906
Formula: C4H10O2S2
MW: 154.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight154.3
XLogP3-0.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass154.01222190
Monoisotopic Mass154.01222190
Topological Polar Surface Area91.1 Ų
Heavy Atom Count8
Formal Charge0
Complexity37
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