The CAS register number of L-Alanine,3-(phenylseleno)- is 71128-82-0. The IUPAC name about this chemical is (2R)-2-amino-3-phenylselanylpropanoic acid. The molecular formula about this chemical is C9H11NO2Se and the molecular weight is 244.15.
Physical properties about L-Alanine,3-(phenylseleno)- are: (1)ACD/LogP: 1.81; (2)ACD/LogD (pH 5.5): -1; (3)ACD/LogD (pH 7.4): -1; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 63.32 Å2; (12)Flash Point: 182.825 °C; (13)Enthalpy of Vaporization: 66.1 kJ/mol; (14)Boiling Point: 378.689 °C at 760 mmHg.
When you are using this chemical, please be cautious about it as the following:
This chemical is toxic by inhalation and if swallowed. There is danger of cumulative effects. This chemicals that at low levels cause damage to health. It may present an immediate or delayed danger to one or more components of the environment. When you are using it, do not eat, drink or smoke and avoid release to the environment. After contact with skin, wash immediately with plenty of soap-suds. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) This material and its container must be disposed of as hazardous waste. If you want to use this chemical, refer to special instructions / safety data sheets.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](N)C[Se]c1ccccc1
(2)InChI: InChI=1/C9H11NO2Se/c10-8(9(11)12)6-13-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1
(3)InChIKey: PFLVUZBNZZOUSS-QMMMGPOBBP
(4)Std. InChI: InChI=1S/C9H11NO2Se/c10-8(9(11)12)6-13-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1
(5)Std. InChIKey: PFLVUZBNZZOUSS-QMMMGPOBSA-N
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