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629-19-6

629-19-6 structural image
Product Name: Propyl disulfide
Formula: C6H14S2
Synonyms: Dipropyl disulfide;Propyl disulfide
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid
Boiling Point 193.00 to 195.00 °C. @ 760.00 mm Hg
Melting Point -85.6 °C
Flash Point 151 °F
Solubility insoluble in water; soluble in ethyl alcohol and oil
Density 0.950-0.960
Refractive Index 1.495-1.500
Kovats Retention Index 1094 1092 1082 1083.9 1090 1094 1093 1095 1092 1102 1105 1104 1104 1093 1096 1096

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Environment
GHS09
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
H411:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P271:Use only outdoors or in a well-ventilated area.
P273:Avoid release to the environment.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 150.3 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 5
Exact Mass 150.05369279 g/mol
Monoisotopic Mass 150.05369279 g/mol
Topological Polar Surface Area 50.6 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 31.5
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

Dipropyl disulfide is an organic disulfide where the alkyl groups specified are propyl. It is a component of the essential oils obtained from Allium. It has a role as a plant metabolite.