2-(1H-Imidazol-1-yl)benzonitrile, 98% 2-(1H-咪唑-1-基)苯甲腈

CAS 25373-49-3 MFCD00127074

化学结构图

25373-49-3
SMILES: N#CC1=CC=CC=C1N1C=NC=C1

化学属性

Mol. FormulaC10H7N3
Mol. Weight169
Melting Point147-151
Density1.422

别名和识别编码

Chemical Name2-(1H-Imidazol-1-yl)benzonitrile, 98%
CAS Number25373-49-3
Alfabeta NameIMIDAZOLYLBENZENECARBONITRILE H211()----
MDL NumberMFCD00127074
EC Number250-023-7
Beilstein Registry Number2384789
Synonym 2-(1H-imidazol-1-yl)benzenecarbonitrile
Chemical Name Translation2-(1H-咪唑-1-基)苯甲腈
PubChem Substance ID329791066
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分类

  • {SNA} Building Blocks, C9 to C30+, Chemical Synthesis, Heterocyclic Building Blocks, Imidazoles
  • {KO} Nitriles

安全信息

Warnings IRRITANT
Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
  • S22 Do not breathe dust 不要吸入粉尘；
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
Risk Statements
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Precautionary statements
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P305+P351+P338
UN Number 3439
Hazard Codes 6.1
Packing GroupIII

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
0
H-bond Acceptors
2
Rotatable Bonds
1
LogP
2

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Imidazoles 咪唑
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Imidazoles 咪唑

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