(1E)-1-(dimethylamino)-4-methylpent-1-en-3-one (E)-1-二甲基氨基-4-甲基-戊-1-烯-3-酮

CAS 5782-56-9 MFCD09859309

化学结构图

5782-56-9
SMILES: CC(C)C(=O)C=CN(C)C

化学属性

Mol. FormulaC8H15NO
Mol. Weight141.21
Melting PointBP: 90 @ 1mBar (°C)
Boiling Point105-107 °C at 2 mmHg

别名和识别编码

Chemical Name1-(Dimethylamino)-4-methyl-1-penten-3-one1-(二甲氨基)-4-甲基-1-戊烯-3-酮
Alfabeta NameDIMETHYLAMINOMETHYLPENTENONE 1413()-------
MDL NumberMFCD09859309
CAS Number5782-56-9
Synonym (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-one {LY} (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-one {} {LY} (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-one {} {} {LY} (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-one {} {} {} {LY} (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-one {} {} {} {} {LY} (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-one {} {} {} {} {} {LY} (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-one {} {} {} {} {} {} {LY} (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-one {} {} {} {} {} {} {} {LY} (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-one {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {LY} (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-one {} {} {} {} {} {} {} {} {} {LY} (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-one {} {} {} {} {} {} {} {} {} {} {LY} (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-one {} {} {} {} {} {} {} {} {} {} {} {LY} (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-one {} {} {} {} {} {} {} {} {} {} {} {} {LY} (1E)-1-(Dimethylamino)-4-methylpent-1-en-3-
Chemical Name Translation(E)-1-二甲基氨基-4-甲基-戊-1-烯-3-酮
PubChem Substance ID12637215
InChIInChI=1S/C8H15NO/c1-7(2)8(10)5-6-9(3)4/h5-7H,1-4H3/b6-5+
Canonical SMILESO=C(C=CN(C)C)C(C)C
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分类

  • {KO} Misc
  • {SNA} Amines, Building Blocks, C8, Chemical Synthesis, Nitrogen Compounds, Organic Building Blocks

安全信息

Warnings IRRITANT
WGK Germany3
Storage condition

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Acceptors
1
Rotatable Bonds
4
H-bond Donors
0
LogP
1

系列性分类

  1. C8 - Amines

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