1-(3-Methylbenzyl)Piperazine 1-(3-甲基苄基)哌嗪

CAS 5321-48-2 MFCD01321003

化学结构图

5321-48-2
SMILES: CC1=CC(CN2CCNCC2)=CC=C1

化学属性

Mol. FormulaC12H18N2
Mol. Weight190.29
Density1.001
Refractive indexn20/D 1.5400(lit.)
Boiling Point256-257 °C at 760 mmHg
Flash Point120 ºC
Melting Point110 °C

别名和识别编码

Chemical Name1-(3-Methylbenzyl)Piperazine
CAS Number5321-48-2
Synonym 1-(3-Methylbenzyl)piperazine {LY} 1-(3-Methylbenzyl)piperazine {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {} {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {} {} {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {} {} {} {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {} {} {} {} {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {} {} {} {} {} {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {} {} {} {} {} {} {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {} {} {} {} {} {} {} {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(3-Methylbenzyl)piperazine {} {} {} {} {} {} {} {} {} {} {} {} {}
EC Number226-184-4
Beilstein Registry Number0147016
MDL NumberMFCD01321003
PubChem Substance ID24883590
Chemical Name Translation1-(3-甲基苄基)哌嗪
InChIKeyVTEOTZPEMDQENX-UHFFFAOYSA-N
Wiswesser Line NotationT6M DNTJ D1R C1
LabNetwork Molecule IDLN00239606
Canonical SMILESCC1=CC(CN2CCNCC2)=CC=C1
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分类

  • {SNA} Building Blocks, C12, Chemical Synthesis, Heterocyclic Building Blocks, Piperazines
  • Aromatics
  • Heterocycles

产品应用

  • Piperazine derivative used as reference materials for forensic laboratories.

相关文献及参考

  • Brady, J., et al.: Drug Dev. Res., 20, 231 (1990),

安全信息

Signal word
GHS Symbol
WGK Germany2
Safety Statements
  • 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 Wear suitable protective clothing 穿戴适当的防护服;
  • 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
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R22 Harmful if swallowed 吞咽有害
Precautionary statements
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
  • H302 Harmful if swallowed 吞食有害
  • H319 Causes serious eye irritation 严重刺激眼睛
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
RTECSTM1400000
Hazard Codes Xn Xn,Xi
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 100 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: AD691-490

Storage condition 2-8°C, protect from light {LY} 2-8°C, protect from light {} {LY} 2-8°C, protect from light {} {} {LY} 2-8°C, protect from light {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • Sigma Aldrich:5321-48-2(sigmaaldrich)
  • MOL 文件:5321-48-2.mol
  • Hazard Note:Irritant
  • 上游原料:乙酸乙酯 --> 甲醇 --> 二氯甲烷 --> 石油醚 --> 甲苯 --> 碳酸钾 --> 哌嗪 --> 3-甲基苄基氯

系列性分类


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