Diallyl disulfide

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Names

[ CAS No. ]:
2179-57-9

[ Name ]:
Diallyl disulfide

[Synonym ]:
2-Propenyl disulfide
3-(prop-2-en-1-yldisulfanyl)prop-1-ene
Diallyl disulfide
EINECS 218-548-6
disulfide, diallyl
Diallyldisulfide
diallyic disulfide
3-(Allyldisulfanyl)prop-1-ene
Allyl disulfide
Disulfide,di-2-propenyl
3-(prop-2-enyldisulfanyl)prop-1-ene
Diallyldisulfide,remainder mainly diallyl sulfide
Allyl disulphide
diallyl disulphide
Disulfide, di-2-propen-1-yl
MFCD00008656
3-(Allyldisulfanyl)-1-propene
4,5-Dithia-1,7-octadiene
diprop-2-en-1-yl disulfide
2-propenyl disulphide

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
185.0±0.0 °C at 760 mmHg

[ Molecular Formula ]:
C6H10S2

[ Molecular Weight ]:
146.274

[ Flash Point ]:
42.4±25.8 °C

[ Exact Mass ]:
146.022385

[ PSA ]:
50.60000

[ LogP ]:
3.26

[ Vapour density ]:
>5 (vs air)

[ Vapour Pressure ]:
1.0±0.3 mmHg at 25°C

[ Index of Refraction ]:
1.534

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
BB1000000
CHEMICAL NAME :
Allyl disulfide
CAS REGISTRY NUMBER :
2179-57-9
BEILSTEIN REFERENCE NO. :
1699241
LAST UPDATED :
199801
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C6-H10-S2
MOLECULAR WEIGHT :
146.28

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
260 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
3600 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
878 mg/kg/6D-I
TOXIC EFFECTS :
Endocrine - other changes Endocrine - changes in spleen weight Blood - pigmented or nucleated red blood cells

MUTATION DATA

TYPE OF TEST :
Sister chromatid exchange
TEST SYSTEM :
Rodent - hamster Ovary
DOSE/DURATION :
10 mg/L
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 35,379,1997

Safety Information

[ Symbol ]:

GHS06

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H301-H315-H319-H335

[ Precautionary Statements ]:
Missing Phrase - N15.00950417-P305 + P351 + P338

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R10;R22;R36/37/38

[ Safety Phrases ]:
S26-S36/37/39-S37/39-S16

[ RIDADR ]:
UN 2810 6.1/PG 3

[ WGK Germany ]:
3

[ RTECS ]:
BB1000000

[ Packaging Group ]:
II

[ Hazard Class ]:
6.1

[ HS Code ]:
3911900004

Synthetic Route

Precursor & DownStream

Precursor

  • Allyl mercaptan
  • allyl bromide
  • ALLYL CHLORIDE
  • allyl thiocyanate
  • allyl toluene-4-sulfonate
  • diallylselenide
  • Allicin
  • Allyl Sulfide
  • allyl iodide
  • S-Allyl-L-cysteine

DownStream

  • 1-ethenylsulfanylprop-1-ene
  • 1,2-bis(1-propylenylthio)ethene
  • Allyl Sulfide
  • (E)-allyl 1-propenyl sulfide
  • di-(1-propanyl) sulfide
  • 1-vinylthio-3-allylthio-1-propene
  • 3-vinyl-4H-1,2-dithiin
  • Diallyl trisulfide
  • Diallyl Tetrasulfide

Customs

[ HS Code ]: 2930909090

[ Summary ]:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Articles

Optimizations of packed sorbent and inlet temperature for large volume-direct aqueous injection-gas chromatography to determine high boiling volatile organic compounds in water.

J. Chromatogr. A. 1356 , 221-9, (2014)

For the expanded application area, fast trace analysis of certain high boiling point (i.e., 150-250 °C) volatile organic compounds (HVOCs) in water, a large volume-direct aqueous injection-gas chromat...

Effect of processing conditions on the organosulfides of shallot (Allium cepa L. Aggregatum group).

J. Agric. Food Chem. 62(23) , 5296-304, (2014)

There is a growing account of the health benefits of H2S as an endogenous cell-signaling molecule. H2S from organic polysulfides, in particular, is increasingly gaining attention for their beneficial ...

The defense substance allicin from garlic permeabilizes membranes of Beta vulgaris, Rhoeo discolor, Chara corallina and artificial lipid bilayers.

Biochim. Biophys. Acta 1850(4) , 602-11, (2015)

Allicin (diallylthiosulfinate) is the major volatile- and antimicrobial substance produced by garlic cells upon wounding. We tested the hypothesis that allicin affects membrane function and investigat...


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Related Compounds

  • Diallyl trisulfide
  • diallyl polysulfides
  • diallyl naphthalene-2,3-dicarboxylate
  • diallyl(hydroxy)acetic acid
  • Diallyl terephthalate
  • diallyl 1,4-dioxa-8,9-diazaspiro[4.6]undecane-8,9-dicarboxylate