3-Amino-3-phenylacrylonitrile (Z)-3-氨基-3-苯基-2-丙烯腈

CAS 1823-99-0 MFCD00015933

化学结构图

1823-99-0
SMILES: N#CC=C(N)c1ccccc1

化学属性

Mol. FormulaC9H8N2
Mol. Weight144.17
Melting Point88-90°

别名和识别编码

Chemical Name3-Amino-3-phenylacrylonitrile
Alfabeta NameAMINOPHENYLPROPENENITRILE Z332()------
MDL NumberMFCD00015933
CAS Number1823-99-0
Chemical Name Translation(Z)-3-氨基-3-苯基-2-丙烯腈
InChIKeyGDJDODGBGRBEAN-TWGQIWQCSA-N
PubChem Substance ID1711920
InChIInChI=1S/C9H8N2/c10-7-6-9(11)8-4-2-1-3-5-8/h1-6H,11H2/b9-6-
Synonym 3-Amino-3-phenylacrylonitrile {LY} 3-Amino-3-phenylacrylonitrile aminocinnamonitrile {} {LY} 3-Amino-3-phenylacrylonitrile {} {} {LY} 3-Amino-3-phenylacrylonitrile {} {} {} {LY} 3-Amino-3-phenylacrylonitrile {} {} {} {} {LY} 3-Amino-3-phenylacrylonitrile {} {} {} {} {} {LY} 3-Amino-3-phenylacrylonitrile {} {} {} {} {} {} {LY} 3-Amino-3-phenylacrylonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Amino-3-phenylacrylonitrile {} {} {} {} {} {} {} {} {LY} 3-Amino-3-phenylacrylonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Amino-3-phenylacrylonitrile {} {} {} {} {} {} {} {} {} {} {LY} 3-Amino-3-phenylacrylonitrile {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Amino-3-phenylacrylonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Amino-3-phenylacrylonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Amino-3-phenylacrylonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Amino-3-phenylacry
Canonical SMILESN#CC=C(N)C=1C=CC=CC1
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分类

  • {KO} Nitriles
  • {KO} AminesPrimary

安全信息

Warnings IRRITANT
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 Donors
1
H-bond Acceptors
1
Rotatable Bonds
2
LogP
6.013000000000000e-001

系列性分类

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