BETA-ASPARTAME ,22839-61-8 _ChemCD

BETA-ASPARTAME

basic_info
Product_Name：	BETA-ASPARTAME
CAS：	22839-61-8
EnglishSynonyms：	H-BETA-ASP-PHE-OME ; N-BETA-L-ASPARTYL-L-PHENYLALANINE METHYL ESTER ; BETA-ASP-PHE METHYL ESTER ; H-ASP(PHE-OME)-OH ; BETA-ASPARTAME ; NB-L-ASPARTYL-L-PHENYLALANINE METHYL ESTER ; BETA-L-ASP-PHE METHYL ESTER ; BETA-L-ASPARTYL-L-PHENYLALANINE METHYL ETHER ; BETA-ASPARTYL-L-PHENYLALANINE-1-METHYL ESTER
pro_mdlNumber：	MFCD00078838
pro_acceptors：	7
pro_donors：	3
pro_smile：	COC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@@H](C(=O)O)N
InChi：	InChI=1S/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-12(17)8-10(15)13(18)19/h2-6,10-11H,7-8,15H2,1H3,(H,16,17)(H,18,19)/t10-,11-/m0/s1
InChiKey：	InChIKey=SHHIPKDJQYIJJF-QWRGUYRKSA-N
property
MeltingPoint：	201-204 DEG C (DEC)(LIT)
Comments：	IMPURITIES: <4% WATER OPTICAL ACTIVITY: [ALPHA]20/D +6 DEG, C = 1 IN H2O UNSPSC: 12352100 WGK: 3
secure_info
secure_wgk_germany：	3

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