CAS 2179-57-9|Diallyl disulfide

Introduction:Basic information about CAS 2179-57-9|Diallyl disulfide, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameDiallyl disulfide
CAS Number2179-57-9Molecular Weight146.274
Density1.0±0.1 g/cm3Boiling Point185.0±0.0 °C at 760 mmHg
Molecular FormulaC6H10S2Melting Point/
MSDSChineseUSAFlash Point42.4±25.8 °C
Symbol
GHS06
Signal WordDanger

Names

Namediallyl disulfide
SynonymMore Synonyms

Diallyl disulfide BiologicalActivity

DescriptionDiallyl disulfide inhibits human squalene monooxygenase with an IC50 of 400 μM for squalene epoxidation[1].
Related CatalogResearch Areas >>CancerSignaling Pathways >>Others >>Others
References

[1]. Gupta N, et al. Garlic and garlic-derived compounds inhibit human squalene monooxygenase. J Nutr. 2001;131(6):1662-1667.

Chemical & Physical Properties

Density1.0±0.1 g/cm3
Boiling Point185.0±0.0 °C at 760 mmHg
Molecular FormulaC6H10S2
Molecular Weight146.274
Flash Point42.4±25.8 °C
Exact Mass146.022385
PSA50.60000
LogP3.26
Vapour density>5 (vs air)
Vapour Pressure1.0±0.3 mmHg at 25°C
Index of Refraction1.534
InChIKeyPFRGXCVKLLPLIP-UHFFFAOYSA-N
SMILESC=CCSSCC=C

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 WordDanger
Hazard StatementsH301-H315-H319-H335
Precautionary StatementsMissing Phrase - N15.00950417-P305 + P351 + P338
Personal Protective EquipmentEyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard CodesXn:Harmful;
Risk PhrasesR10;R22;R36/37/38
Safety PhrasesS26-S36/37/39-S37/39-S16
RIDADRUN 2810 6.1/PG 3
WGK Germany3
RTECSBB1000000
Packaging GroupII
Hazard Class6.1
HS Code3911900004

Customs

HS Code2930909090
Summary2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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Synonyms

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
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