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CAS No.: | 15920-93-1 |
---|---|
Name: | 3-(N-Methylamino)-L-alanine |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C4H10N2O2 |
Molecular Weight: | 246.396 |
Synonyms: | Propionicacid, 2-amino-3-(methylamino)-, L- (8CI);3-(Methylamino)-L-alanine;BMMA;L-(b-Methylamino)alanine;L-a-Amino-b-(methylamino)propionic acid;S(+)-b-Methyl-a,b-diaminopropionic acid;b-(N-Methylamino)-L-alanine; |
Density: | 1.157 g/cm3 |
Boiling Point: | 284.2 °C at 760 mmHg |
Flash Point: | 125.7 °C |
Solubility: | H2O: solutions may be stored for several days at 40 °C |
Safety: | 22-24/25 |
PSA: | 75.35000 |
LogP: | -0.29110 |
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The CAS register number of 3-(N-Methylamino)-L-alanine is 15920-93-1. It also can be called as L-Alanine, 3-(methylamino)- and the IUPAC name about this chemical is (2S)-2-amino-3-(methylamino)propanoic acid. It belongs to the following product categories, such as Amino Acids, Amino Acids & Derivatives, Neurochemicals and so on. When you are using it, please avoid contact with skin and eyes and do not breathe dust.
Physical properties about 3-(N-Methylamino)-L-alanine are: (1)ACD/LogP: -0.85; (2)ACD/LogD (pH 5.5): -4.03; (3)ACD/LogD (pH 7.4): -3.38; (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: 4; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 32.78Å2; (12)Index of Refraction: 1.484; (13)Molar Refractivity: 29.23 cm3; (14)Molar Volume: 102 cm3; (15)Polarizability: 11.58x10-24cm3; (16)Surface Tension: 47.1 dyne/cm; (17)Enthalpy of Vaporization: 57.57 kJ/mol; (18)Boiling Point: 284.2 °C at 760 mmHg; (19)Vapour Pressure: 0.000783 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](N)CNC
(2)InChI: InChI=1/C4H10N2O2/c1-6-2-3(5)4(7)8/h3,6H,2,5H2,1H3,(H,7,8)/t3-/m0/s1
(3)InChIKey: UJVHVMNGOZXSOZ-VKHMYHEABZ
(4)Std. InChI: InChI=1S/C4H10N2O2/c1-6-2-3(5)4(7)8/h3,6H,2,5H2,1H3,(H,7,8)/t3-/m0/s1
(5)Std. InChIKey: UJVHVMNGOZXSOZ-VKHMYHEASA-N