(2S-CIS)-(-)-5-BENZYL-3,6-DIOXO-2-PIPERAZINEACETIC ACID

pro_cas
5262-10-2
pro_cdbregno
CCD00090489
pro_formula
C13 H14 N2 O4
pro_molWeight
262.264

basic_info

Product_Name: (2S-CIS)-(-)-5-BENZYL-3,6-DIOXO-2-PIPERAZINEACETIC ACID
CAS: 5262-10-2
EnglishSynonyms: (2S-CIS)-(-)-5-BENZYL-3,6-DIOXO-2-PIPERAZINEACETIC ACID ; CYCLO(-ASP-PHE) ; CYCLO(L-ASP-L-PHE) ; ASPARTAME-RELATED COMPOUND A ; (3S)-CARBOXYMETHYL-(6S)-BENZYL-2,5-DIKETOPIPERAZINE ; (2S,5S)-5-BENZYL-3,6-DIOXO2-PIPERAZINEACETIC ACID
pro_mdlNumber: MFCD00190764
pro_acceptors: 6
pro_donors: 3
pro_smile: c1ccc(cc1)C[C@H]2C(=O)N[C@H](C(=O)N2)CC(=O)O
InChi: InChI=1S/C13H14N2O4/c16-11(17)7-10-13(19)14-9(12(18)15-10)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,14,19)(H,15,18)(H,16,17)/t9-,10-/m0/s1
InChiKey: InChIKey=VNHJXYUDIBQDDX-UWVGGRQHSA-N

property

MeltingPoint: 270-272 DEG C(LIT)
Comments: OPTICAL ACTIVITY: [ALPHA]20/D -9.0 DEG, C = 0.9 IN ACETIC ACID
UNSPSC: 12352100
WGK: 3

secure_info

secure_symbol: GHS07 GHS07
secure_signal_word: Warning
secure_risk_stmt: H315-H319-H335
secure_cautionary_stmt: P261-P305 + P351 + P338
secure_damage_code: Xi
secure_risk_disclosure_stmt: R:36/37/38
secure_security_stmt: S:26-36
secure_wgk_germany: 3

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