Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Diallyl trisulfide |
EINECS | 218-107-8 |
CAS No. | 2050-87-5 | Density | 1.116 g/cm3 |
PSA | 75.90000 | LogP | 3.38800 |
Solubility | N/A | Melting Point |
N/A |
Formula | C6H10S3 | Boiling Point | 229.5 °C at 760 mmHg |
Molecular Weight | 178.343 | Flash Point | 87.8 °C |
Transport Information | UN 2810 | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Allyltrisulfide (6CI,7CI,8CI);Trisulfide, di-2-propenyl (9CI);Allitride;Allitridin;Allitridum;Di(2-propenyl) trisulfide;NSC651936; |
Article Data | 15 |
Conditions | Yield |
---|---|
Stage #1: allyl bromide With Sodium thiosulfate pentahydrate In ethanol; water at 20℃; Stage #2: With sodium sulfide nonahydrate In water at 0 - 20℃; for 5h; | 50% |
Conditions | Yield |
---|---|
With sulfur; potassium hydroxide; water In tetrahydrofuran for 2h; Ambient temperature; | A 30% B 10% |
Conditions | Yield |
---|---|
(i) Na2S2O3*5H2O, aq. EtOH, (ii) Na2S; Multistep reaction; |
Conditions | Yield |
---|---|
With pyridine In diethyl ether for 0.5h; Yield given; |
diallyl disulphide
A
3-vinyl-4H-<1,2>-dithiin
B
diallyl sulphide
C
diallyl trisulfide
D
diallyl tetrasulfide
Conditions | Yield |
---|---|
at 50℃; for 168h; Further byproducts given; | A 0.7 % Chromat. B 3 % Chromat. C 9.7 % Chromat. D 0.47 % Chromat. |
diallyl disulphide
A
diallyl sulphide
B
diallyl trisulfide
C
diallyl tetrasulfide
D
5-methyl-4,7-dithiadeca-1,9-diene
Conditions | Yield |
---|---|
at 80℃; for 240h; Further byproducts given; | A 20 % Chromat. B 18 % Chromat. C 5.5 % Chromat. D 0.45 % Chromat. |
diallyl disulphide
A
diallyl sulphide
B
diallyl trisulfide
C
diallyl tetrasulfide
D
2‐ethenyl‐4H‐1,3‐dithiine
Conditions | Yield |
---|---|
at 50℃; for 168h; Further byproducts given; | A 3 % Chromat. B 9.7 % Chromat. C 0.47 % Chromat. D 0.3 % Chromat. |
diallyl disulphide
A
diallyl sulphide
B
diallyl trisulfide
C
diallyl tetrasulfide
Conditions | Yield |
---|---|
at 80℃; for 240h; Further byproducts given; | A 20 % Chromat. B 18 % Chromat. C 5.5 % Chromat. D 0.68 % Chromat. |
diallyl disulphide
A
diallyl sulphide
B
diallyl trisulfide
C
diallyl tetrasulfide
Conditions | Yield |
---|---|
at 80℃; for 240h; Further byproducts given; | A 20 % Chromat. B 18 % Chromat. C 5.5 % Chromat. D 0.42 % Chromat. |
diallyl disulphide
A
diallyl sulphide
B
diallyl trisulfide
C
diallyl tetrasulfide
Conditions | Yield |
---|---|
at 80℃; for 240h; Further byproducts given; | A 20 % Chromat. B 18 % Chromat. C 5.5 % Chromat. D 0.86 % Chromat. |
Molecular Structure of Diallyl trisulfide (CAS NO.2050-87-5):
IUPAC Name: 3-(Prop-2-enyltrisulfanyl)prop-1-ene
Molecular Formula: C6H10S3
Molecular Weight: 178.34
EINECS: 218-107-8
FEMA: 3265
Index of Refraction: 1.581
Molar Refractivity: 53.28 cm3
Molar Volume: 159.6 cm3
Surface Tension: 39.7 dyne/cm
Density: 1.116 g/cm3
Flash Point: 87.8 °C
Enthalpy of Vaporization: 44.71 kJ/mol
Boiling Point: 229.5 °C at 760 mmHg
Vapour Pressure: 0.105 mmHg at 25 °C
Product Categories: sulfide Flavor
Canonical SMILES: C=CCSSSCC=C
InChI: InChI=1S/C6H10S3/c1-3-5-7-9-8-6-4-2/h3-4H,1-2,5-6H2
InChIKey: UBAXRAHSPKWNCX-UHFFFAOYSA-N
Classification Code: Anti-Infective Agents; Antifungal agents; Antilipemic agents; Antimetabolites; Antioxidants; Antiparasitic Agents; Antiprotozoal agents; Antispermatogenic Agents; Contraceptive Agents; Contraceptive Agents, Female; Hematologic Agents; Insecticides; Noxae; Pesticides; Platelet aggregation inhibitors; Protective Agents; Reproductive Control Agents; Spermatocidal agents
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | oral | 100mg/kg (100mg/kg) | Drug and Chemical Toxicology. Vol. 3, Pg. 249, 1980. |
Safety Information of Diallyl trisulfide (CAS NO.2050-87-5):
RIDADR: 2810
HazardClass: 6.1(b)
PackingGroup: III
Diallyl trisulfide (CAS NO.2050-87-5), its Synonyms are Di-2-propenyl trisulfide ; Trisulfide, di-2-propenyl ; Diallyl trisulphide ; Trisulfide, di-2-propenyl (9CI) ; Allyl trisulfide .