2-(5-ノルボルネン-2,3-ジカルボキシイミド)-1,1,3,3-テトラメチルウロニウムテトラフルオロボラート

(Dimethylamino)((1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)oxy)-N,N-dimethylmethaniminium tetrafluoroborate

HCID 14309593CAS 125700-73-4

部分構造検索類似構造を探す

基本情報

標準SMILES: CN(C)C(ON1C(=O)C2C3C=CC(C3)C2C1=O)=[N+](C)C.F[B-](F)(F)F
InChIKey: DMTWWFCCBWWXSA-UHFFFAOYSA-N
分子式: C14H20BF4N3O3
平均分子量: 365.13 g/mol
単同位体質量: 365.1533843

名称と識別子

優先名称: (Dimethylamino)((1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)oxy)-N,N-dimethylmethaniminium tetrafluoroborate
IUPAC: [dimethylamino-[(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)oxy]methylidene]-dimethylazanium tetrafluoroborate
現地名: 2-(5-ノルボルネン-2,3-ジカルボキシイミド)-1,1,3,3-テトラメチルウロニウムテトラフルオロボラート
英語名: 2-(5-Norborene-2,3-dicarboximido)-1,1,3,3-tetramethyluronium tetrafluoroborate
分子式: C14H20N3O3.BF4
分子量: 365.13

名称と別名

DTXSID10558769(Dimethylamino)((1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)oxy)-N,N-dimethylmethaniminium tetrafluoroborate(Dimethylamino)[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)oxy]-N,N-dimethylmethaniminium tetrafluoroborateRefChem:1050854DTXCID60509549125700-73-4TNTU2-(1,3-Dioxo-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindol-2(3H)-yl)-1,1,3,3-tetramethyluronium tetrafluoroborateMethanaminium, N-[(dimethylamino)[(1,3,3a,4,7,7a-hexahydro-1,3-dioxo-4,7-methano-2H-isoindol-2-yl)oxy]methylene]-N-methyl-, tetrafluoroborate(1-) (1:1)2-(5-Norborene-2,3-dicarboximido)-1,1,3,3-tetramethyluronium tetrafluoroborate2-(endo-5-norbornene-2.3-dicarboxylimide)- -1,1,3,3-tetramethyluroniumtetrafluoroborate[Dimethylamino-[(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)oxy]methylidene]-dimethylazanium;tetrafluoroborate

名称をさらに表示

2-(5-ノルボルネン-2,3-ジカルボキシイミド)-1,1,3,3-テトラメチルウロニウムテトラフルオロボラートTNTU extrapure, 99%TNTU TETRAFLUOROBORATE[Coupling Reagent for Peptide]O-(5-NORBORNENE-2 3-DICARBOXIMIDO)-TETR&O-(5-Norbornene-2,3-dicarboximido)-N,N,N′,N′-tO-(5-Norbornene-2,3-dicarboximido)-N,N,N′,N′-tetO-(5-NORBORNENE-2,3-DICARBOXIMIDO)-*N,N, N',N'-TETRAnorbornenedicarboximido tetramethyluronium fluoroborateO-(5-NORBORNENE-2,3-DICARBOXIMIDO)-N,N,N',N'-TETRAMETHYLURONIUM

MFCD001677532-(5-Norbornene-2,3-dicarboximido)-1,1,3,3-tetramethyluronium TetrafluoroborateC14H20BF4N3O3SCHEMBL360038SCHEMBL15956657DMTWWFCCBWWXSA-UHFFFAOYSA-NO-(Bicyclo[2.2.1]hept-5-ene-2,3-dicarboximido)-N,N,N',N'-tetramethyluronium tetrafluoroborateMFCD07369131

データベース識別子

CAS: 125700-73-4
PubChem CID: 14309593
DTXSID: DTXSID10558769

物性

構造計算による物性

極性表面積: 52.9 Å²
水素結合供与体数: 0
水素結合受容体数: 8
回転可能結合数: 3
重原子数: 25
形式電荷: 0
複雑度: 510

物理化学的性質

融点: 216 · 216-219 °C(lit.)
貯蔵温度: 2 · Keep in dark place,Inert atmosphere,2-8°C
水溶解度: Slightly soluble in water
外見: powder to crystal
色: White to Almost white
InChI: InChI=1S/C14H20N3O3.BF4/c1-15(2)14(16(3)4)20-17-12(18)10-8-5-6-9(7-8)11(10)13(17)19;2-1(3,4)5/h5-6,8-11H,7H2,1-4H3;/q+1;-1
InChIKey: DMTWWFCCBWWXSA-UHFFFAOYSA-N
SMILES: [B+3]([F-])([F-])([F-])[F-].O=C1N(C(=O)C2C3C=CC(C3)C12)O/C(=[N+](\C)/C)/N(C)C
CAS データベース: 125700 · 125700-73-4(CAS DataBase Reference)