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Trimethylene sulfide

CAT: 0024-sc-237346Size: 10 mLDry Ice: NoHazardous: No
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CAT#:0024-sc-237346Size:10 mL
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CAS Number
287-27-4

Chemical Information

Thietane

Thietane is an organosulfur heterocyclic compound containing a saturated four membered ring with 3 carbon atoms and 1 sulfur atom. It has a role as a metabolite. It is a saturated organic heteromonocyclic parent and an organosulfur heterocyclic compound.

CAS Number287-27-4
PubChem CID9251
IUPAC Namethietane
Molecular FormulaC3H6S
Molecular Weight74.15
XLogP1
Topological Polar Surface Area25.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count4
Formal Charge0
Complexity17
SMILES
C1CSC1
InChI
InChI=1S/C3H6S/c1-2-4-3-1/h1-3H2
InChIKey
XSROQCDVUIHRSI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Thietane
CAS: 287-27-4
CID: 9251
Formula: C3H6S
MW: 74.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight74.15
XLogP31
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass74.01902136
Monoisotopic Mass74.01902136
Topological Polar Surface Area25.3 Ų
Heavy Atom Count4
Formal Charge0
Complexity17.2
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

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Alternative Products

CatalogName
290793-01Trimethylene sulfide
T27785-01Trimethylene sulfide 97%
T21150-01Trimethylene carbonate
15794792Trimethylene oxide
35109-62Trimethylene Glycol
468219-01Trimethylene Di (thiotosylate)
TRC-T796183-2.5GTrimethylene Di(thiotosylate)
POL-DG029Poly (trimethylene carbonate)
TRC-E686780-750MGEthyl Trimethylene Phosphate
OR8417-01Bis (trimethylene) diborate

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