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Ethionamide

CAT: 0607-A8429-5.1Size: 10 mM (in 1mL DMSO)Dry Ice: NoHazardous: No
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CAT#:0607-A8429-5.1Size:10 mM (in 1mL DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Anti-tuberculosis antibiotic
CAS Number
536-33-4
Product Name Alternative
2-ethylpyridine-4-carbothioamide
Field of Research
Microbiology & Virology Antibiotic
Purity
0.9976
Form
A solid
Solubility
≥7.65 mg/mL in DMSO
Smiles
CCC1=NC=CC(=C1)C(=S)N
Molecular Formula
C8H10N2S
Molecular Weight
166.24
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Ethionamide

Ethionamide can cause developmental toxicity according to state or federal government labeling requirements.

CAS Number536-33-4
PubChem CID2761171
IUPAC Name2-ethylpyridine-4-carbothioamide
Molecular FormulaC8H10N2S
Molecular Weight166.25
XLogP1.1
Topological Polar Surface Area71
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity147
SMILES
CCC1=NC=CC(=C1)C(=S)N
InChI
InChI=1S/C8H10N2S/c1-2-7-5-6(8(9)11)3-4-10-7/h3-5H,2H2,1H3,(H2,9,11)
InChIKey
AEOCXXJPGCBFJA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethionamide
CAS: 536-33-4
CID: 2761171
Formula: C8H10N2S
MW: 166.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight166.25
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass166.05646950
Monoisotopic Mass166.05646950
Topological Polar Surface Area71 Ų
Heavy Atom Count11
Formal Charge0
Complexity147
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

Alternative Products

CatalogName
E010-5GEthionamide

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