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CAS No.: | 26046-90-2 |
---|---|
Name: | 3-(Methylseleno)-L-alanine |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C4H9NO2Se |
Molecular Weight: | 182.081 |
Synonyms: | Alanine,3-(methylselenyl)-, L- (8CI);3-(Methylseleno)-L-alanine;Methylseleno-L-cysteine;Methylselenocysteine;Se-Methylselenocysteine; |
Melting Point: | 177 °C(dec.) |
Boiling Point: | 327.976 °C at 760 mmHg |
Flash Point: | 152.155 °C |
Appearance: | white to slightly yellow powder |
Hazard Symbols: | T,N |
Risk Codes: | 23/25-33-50/53 |
Safety: | 20/21-28-45-60-61-28A |
Transport Information: | UN 3283 6.1/PG 2 |
PSA: | 63.32000 |
LogP: | 0.26920 |
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The CAS register number of 3-(Methylseleno)-L-alanine is 26046-90-2. It also can be called as (R)-2-Amino-3-methylselanyl propionic acid and the IUPAC name about this chemical is (2R)-2-amino-3-methylselanylpropanoic acid. The molecular formula about this chemical is C4H9NO2Se and the molecular weight is 182.08. It belongs to the following product categories, such as Antioxidant and Free Radical ScavengersApoptosis and Cell Cycle; Cell Cycle; Cell Cycle Regulators; AntioxidantCancer Research; Biochemicals Found in Plants; Chemopreventive Agents; Nutrition Research and so on.
Physical properties about 3-(Methylseleno)-L-alanine are: (1)ACD/LogP: 1.75 ; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 5; (9)Polar Surface Area: 88.13Å2; (10)Flash Point: 152.155 °C; (11)Enthalpy of Vaporization: 62.695 kJ/mol; (12)Boiling Point: 327.976 °C at 760 mmHg.
When you are using this chemical, please be cautious about it as the following:
This chemical is very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment and it is toxic by inhalation and if swallowed, it also has danger of cumulative effects. When you are using it, please do not eat or drink and do not smoke, you also need avoid release to the environment. Refer to special instructions / safety data sheets. After contact with skin, you need wash immediately with plenty of soap-suds. This material and its container must be disposed of as hazardous waste. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)C(CS)N[Se]C
(2)InChI: InChI=1/C4H9NO2SSe/c1-9-5-3(2-8)4(6)7/h3,5,8H,2H2,1H3,(H,6,7)
(3)InChIKey: ZQESFJHUBLOAGZ-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C4H9NO2SSe/c1-9-5-3(2-8)4(6)7/h3,5,8H,2H2,1H3,(H,6,7)
(5)Std. InChIKey: ZQESFJHUBLOAGZ-UHFFFAOYSA-N