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ALLIIN |
| Synonyms. Alliin; (+)-L-Alliin; 3-(Allylsulfinyl)alanine; S-Allyl-L-cystein-S-oxide; S-Allyl-L-cysteine-(+)-sulfoxide; (S)-3-(Allylsulphinyl)-L-alanine; (S)-3-(2-Propenylsulfinyl)-L-alanine; (S(S))-S-2-Propen-1-yl-L-cysteine S-oxide; (S)-S-Allyl-L-cysteine sulfoxide; (S)-L-3-(Allylsulfinyl)alanine; (2R)-2-Amino-3-[(S)-prop-2-enylsulfinyl]propanoic acid; |
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| PRODUCT IDENTIFICATION | |
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CAS RN |
556-27-4 |
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EINECS RN |
209-118-9 |
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FORMULA |
C6H11NO3S |
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MOLE WEIGHT |
177.22 |
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H.S CODE |
2930.90.9190 |
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SMILES |
C=CC[S@@+](C[C@@H](C(=O)O)N)[O-] |
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CLASSIFICATION |
Sulfoxide, Nutrition |
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EXTRA NOTES |
Other RN: 23358-38-5 |
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| PHYSICAL AND CHEMICAL PROPERTIES | |
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PHYSICAL STATE |
white to off-white crystalline powder |
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MELTING POINT |
165 C |
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BOILING POINT |
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DENSITY |
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SOLUBILITY IN WATER |
Soluble |
| SOLVENT SOLUBILITY |
Practically insoluble in abs ethanol, chloroform, acetone, ether, benzene |
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VAPOR DENSITY |
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log P(octanol-water) |
-4.2 |
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VAPOR PRESSURE |
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AUTOIGNITION TEMP |
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| pK |
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REFRACTIVE INDEX |
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FLASH POINT |
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| STABILITY AND REACTIVITY | |
| STABILITY | Stable under normal conditions. |
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INCOMPATIBLE MATERIALS |
Strong oxidizing agents. |
| POLYMERIZATION |
Has not been reported |
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NFPA RATINGS |
Health: 2, Flammability: 0, Reactivity: 0 |
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| EXTERNAL LINKS & GENERAL DESCRIPTION |
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USA.gov - Alliin Wikipedia Linking - Alliin Google Scholar Search - Alliin U.S. National Library of Medicine - Alliin PubChem Compound Summary - Alliin KEGG (Kyoto Encyclopedia of Genes and Genomes) - Alliin NCBI (http://www.ncbi.nlm.nih.gov/) - Alliin Human Metabolome Database - Alliin |
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| SALES SPECIFICATION | |
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APPEARANCE |
white to off-white crystalline powder |
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ASSAY |
98% min |
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MELTING POINT |
164 ~ 166 C |
| OPTICAL ROTATION |
+62.5° ~ +64.5° (c=2) |
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LOSS ON DRYING |
1% max |
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HEAVY METALS |
10ppm max |
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| TRANSPORT & REGULATORY INFORMATION | |
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UN NO. |
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| HAZARD CLASS |
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| PACKING GROUP | |
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| SAFETY INFORMATION | |
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HAZARD OVERVIEW |
GHS (Globally Harmonised System) Classification: Acute toxicity (Oral). Skin irritation. Eye irritation. Specific target organ toxicity. Hazard statements: May be harmful if swallowed. Causes skin irritation. Causes serious eye irritation. May cause respiratory irritation. |
| SIGNAL WORD | Warning |
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PICTOGRAMS |
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HAZARD STATEMENTS |
H315-H319-H335 |
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P STATEMENTS |
P261-P305 + P351 + P338 |
| EC DIRECTIVES |
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| HAZARD CODES |
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RISK PHRASES |
36/37/38 |
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SAFETY PHRASES |
26 |
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| PACKING |
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Preserved in light-resistant and well-closed bottles |
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