(S)-5-苄基-2-均三甲苯基-6,6-二甲基-6,8-二氢-5H-[1,2,4]三氮唑并[3,4-c][1,4]噁嗪-2-四氟硼酸鎓盐

pro_cas
925706-40-7
pro_cdbregno
CCD03028369
pro_formula
C23 H28 N3 O . B F4
pro_molWeight
449.297

basic_info

Product_Name: (S)-5-苄基-2-均三甲苯基-6,6-二甲基-6,8-二氢-5H-[1,2,4]三氮唑并[3,4-c][1,4]噁嗪-2-四氟硼酸鎓盐
CAS: 925706-40-7
中文同义词: (S)-5-苄基-2-均三甲苯基-6,6-二甲基-6,8-二氢-5H-[1,2,4]三氮唑并[3,4-c][1,4]噁嗪-2-四氟硼酸鎓盐
EnglishSynonyms: (S)-5-BENZYL-2-MESITYL-6,6-DIMETHYL-6,8-DIHYDRO-5H-[1,2,4]TRIAZOLO[3,4-C][1,4]OXAZIN-2-IUM TETRAFLUOROBORATE
pro_mdlNumber: MFCD16621403
pro_acceptors: 4
pro_donors: 0
pro_smile: [B-](F)(F)(F)F.Cc1cc(c(c(c1)C)[n+]2cn3c(n2)COC([C@@H]3Cc4ccccc4)(C)C)C
InChi: InChI=1S/C23H28N3O.BF4/c1-16-11-17(2)22(18(3)12-16)26-15-25-20(13-19-9-7-6-8-10-19)23(4,5)27-14-21(25)24-26;2-1(3,4)5/h6-12,15,20H,13-14H2,1-5H3;/q+1;-1/t20-;/m0./s1
InChiKey: InChIKey=PVYSZYZMWZCJCT-BDQAORGHSA-N

property

MeltingPoint: 200-206 DEG C
Comments: APPLICATION: CATALYST FOR: INTERMOLECULAR CONJUGATE ADDITION OF ALCOHOLS TO UNSATURATED KETONES AND ESTERS PREPARATION OF BETA-AMINO CARBONYL COMPOUNDS BY N-HETEROCYCLIC CARBENE-CATALYZED ENANTIOSELECTIVE MANNICH REACTIONS OF A-ARYLOXYACETALDEHYDES WITH IMINES ASYMMETRIC SYNTHESIS OF CYCLOPENTENES FROM ALLYL DIKETONES BY CARBENE-CATALYZED INTRAMOLECULAR ALDOL REACTION, LACTONIZATION, AND CARBON DIOXIDE EXPULSION PREPARATION OF ESTERS VIA TANDEM OXIDATION OF ALLYLIC/BENZYLIC/PROPARGYL ALCOHOLS OR ALDEHYDE
OPTICAL ACTIVITY: [ALPHA]/D -117.8 DEG, C = 0.5 IN CHLOROFORM
WGK: 3

secure_info

secure_risk_stmt: H413
secure_wgk_germany: 3

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