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L-Phenylalanine,N-(3,3-dimethylbutyl)-L-a-aspartyl-,2-methyl ester (165450-17-9)

Identification
Name:L-Phenylalanine,N-(3,3-dimethylbutyl)-L-a-aspartyl-,2-methyl ester
Synonyms:L-Phenylalanine,N-[N-(3,3-dimethylbutyl)-L-a-aspartyl]-,1-methyl ester;
CAS:165450-17-9
Molecular Formula: C20H30N2O5
Molecular Weight: 378.4626
InChI: InChI=1S/C20H30N2O5/c1-20(2,3)10-11-21-15(13-17(23)24)18(25)22-16(19(26)27-4)12-14-8-6-5-7-9-14/h5-9,15-16,21H,10-13H2,1-4H3,(H,22,25)(H,23,24)/t15-,16-/m1/s1
Molecular Structure: (C20H30N2O5) L-Phenylalanine,N-[N-(3,3-dimethylbutyl)-L-a-aspartyl]-,1-methyl ester;
Properties
Density:1.133 g/cm3
Refractive index:1.521
Water Solubility:Sparingly Soluble in water, very soluble in Ethanol
Solubility:Sparingly Soluble in water, very soluble in Ethanol
Appearance:White or off white crystalline powder
Specification:

The chemical synonyms of? Neotame (165450-17-9) are Neotame (200 MG) ; Neotame ; N-(N-(3,3-Dimethylbutyl)-L-alpha-aspartyl)-L-phenylalanine 1-methyl ester ; L-phenylalanine, N-[N-(3,3-Dimethylbutyl)-L-.ALPHA.-ASPARTYL]-, 1-methyl ester ; and?N-[N-(3,3-Dimethylbutyl)-L--aspartyl]-L-phenylalanine 1-methyl ester .
?Neotame (165450-17-9) is an artificial sweetener made by NutraSweet that is between 7,000 and 13,000 times sweeter than sucrose (table sugar). In the European Union it is known by the E number E961. Neotame (165450-17-9) is moderately heat stable and extremely potent. Neotame is rapidly metabolized, completely eliminated, and does not accumulate in the body.
The major metabolic pathway is hydrolysis of the methyl ester by esterases that are present throughout the body, which yields de-esterified neotame and methanol. Because only trace amounts of neotame are needed to sweeten foods, the amount of methanol derived from neotame is much lower than that found in common foods, such as fruit and vegetable juices.
The product is attractive to food manufacturers as its use greatly lowers the cost of production compared to using sugar or high fructose corn syrup (due to the lower quantities needed to achieve the same sweetening) while also benefitting the consumer by providing fewer "empty" sugar calories and a lower impact on blood sugar.
It is chemically similar to the artificial sweetener aspartame, but it?is used at vastly lower levels and is more stable. Chemically, it has a 3,3-dimethylbutyl group attached to the amino group of the aspartic acid portion of the molecule. Peptidases, which would typically break the peptide bond between the aspartic acid and phenylalanine moieties, are effectively blocked by the presence of the 3,3-dimethylbutyl moiety, thus reducing the production of phenylalanine, thereby making its consumption by those who suffer from phenylketonuria safe.

Safety Data