Methanaminium, N-((1H-benzotriazol-1-yloxy)(dimethylamino)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1)

HCID 2733084CAS 625384-22-7

基本情報

標準SMILES
CN(C)C(On1nnc2ccccc21)=[N+](C)C.F[P-](F)(F)(F)(F)F
InChIKey
UQYZFNUUOSSNKT-UHFFFAOYSA-N
分子式
C11H16F6N5OP
平均分子量
379.24 g/mol
単同位体質量
379.09966608

名称と識別子

優先名称
Methanaminium, N-((1H-benzotriazol-1-yloxy)(dimethylamino)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1)
IUPAC
[benzotriazol-1-yloxy(dimethylamino)methylidene]-dimethylazanium hexafluorophosphate

名称と別名

625384-22-7DTXSID101335774Methanaminium, N-((1H-benzotriazol-1-yloxy)(dimethylamino)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1)Methanaminium, N-[(1H-benzotriazol-1-yloxy)(dimethylamino)methylene]-N-methyl-, hexafluorophosphate(1-) (1:1)RefChem:1089040DTXCID601765647HBTU2-(1h-benzotriazole-1-yl)-1,1,3,3-tetramethyluronium hexafluorophosphateo-Benzotriazol-1-yl-N,N,N',N'-tetramethyluronium hexafluorophosphateMFCD00075445N,N,N',N'-Tetramethyl-O-(1H-benzotriazol-1-yl)uronium hexafluorophosphate[benzotriazol-1-yloxy(dimethylamino)methylene]-dimethyl-ammonium hexafluorophosphate
名称をさらに表示
[benzotriazol-1-yloxy(dimethylamino)methylidene]-dimethylazanium;hexafluorophosphateo-(1h-benzotriazol-1-yl)-n,n,n',n'-tetramethyluronium hexafluorophosphateO-benzotriazol-1-yl-N,N,N',N'-tetramethyluroniumhexafluorophosphateC11H16F6N5OP2-[1H-benzotriazole-1-yl]-1,1,3,3-tetramethyluronium hexafluorophosphateHBTU Reagent1-[Bis(dimethylamino)methylene]-1H-benzotriazolium Hexafluorophosphate(1-) 3-Oxide; N-HBTU;HBTU [O-Benzotriazole-N,N,N',N'-tetramethyl-uronium-hexafluoro-phosphate]

データベース識別子

CAS
625384-22-7
PubChem CID
2733084
DTXSID
DTXSID101335774

物性

構造計算による物性

極性表面積
46.2 Ų
水素結合供与体数
0
水素結合受容体数
10
回転可能結合数
3
重原子数
24

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