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287-27-4

287-27-4 structural image
Product Name: TRIMETHYLENE SULFIDE
Formula: C3H6S
Synonyms: Thietane
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 743

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Flame
Flammables
GHS02

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H225:Flammable liquids
H302:Acute toxicity,oral
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.

COMPUTED DESCRIPTORS

Molecular Weight 74.15 g/mol
XLogP3 1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 74.01902136 g/mol
Monoisotopic Mass 74.01902136 g/mol
Topological Polar Surface Area 25.3 Ų
Heavy Atom Count 4
Formal Charge 0
Complexity 17.2
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

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 an organosulfur heterocyclic compound and a saturated organic heteromonocyclic parent.