Trans-2-Nitrocinnamic Acid 反式-2-硝基肉桂酸

CAS 1013-96-3 MFCD00007189

化学结构图

1013-96-3
SMILES: O=C(O)/C=C/c1ccccc1[N+](=O)[O-]

化学属性

Mol. FormulaC9H7NO4
Mol. Weight193.16
Melting Point243-245°C
TSCANo
Appearance 浅黄色结晶。熔点243-245℃。
Solubilityinsoluble
Density1.411
Boiling Point383.3°C at 760 mmHg

别名和识别编码

Chemical NameTrans-2-Nitrocinnamic Acid
Alfabeta NameNITROPHENYLACRYLICACID 32()--
MDL NumberMFCD00007189
Synonym (E)-2-Nitrocinnamic acid {LY} (E)-2-Nitrocinnamic acid {} {LY} (E)-2-Nitrocinnamic acid {} {} {LY} (E)-2-Nitrocinnamic acid {} {} {} {LY} (E)-2-Nitrocinnamic acid {} {} {} {} {LY} (E)-2-Nitrocinnamic acid {} {} {} {} {} {LY} (E)-2-Nitrocinnamic acid {} {} {} {} {} {} {LY} (E)-2-Nitrocinnamic acid {} {} {} {} {} {} {} {LY} (E)-2-Nitrocinnamic acid {} {} {} {} {} {} {} {} {LY} (E)-2-Nitrocinnamic acid {} {} {} {} {} {} {} {} {} {LY} (E)-2-Nitrocinnamic acid {} {} {} {} {} {} {} {} {} {} {LY} (E)-2-Nitrocinnamic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (E)-2-Nitrocinnamic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} (E)-2-Nitrocinnamic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (E)-2-Nitrocinnamic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (E)-2-Nitrocinnamic acid
Beilstein Registry Number9(1)246
PubChem Substance ID735923
CAS Number1013-96-3
EC Number210-309-4
Chemical Name Translation反式-2-硝基肉桂酸
Reaxys-RN975871
InChIKeyBBQDLDVSEDAYAA-AATRIKPKSA-N
LabNetwork Molecule IDLN00152233
InChIInChI=1S/C9H7NO4/c11-9(12)6-5-7-3-1-2-4-8(7)10(13)14/h1-6H,(H,11,12)/b6-5+
Canonical SMILESOC(/C=C/C1=CC=CC=C1[N+]([O-])=O)=O
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分类

  • Building Blocks, C9, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks
  • {SNA} Building Blocks, C9, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks

相关文献及参考

  • Beilstein:9(1)246

安全信息

Warnings IRRITANT
WGK Germany3
RTECSUD3642850
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
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;
  • S37 Wear suitable gloves 戴适当手套;
  • S22 Do not breathe dust 不要吸入粉尘;
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触;
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
Hazard Codes Xi
GHS Symbol
Signal word
Precautionary statements
  • 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。
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服,清洗后方可重新使用
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P302+P352+P332+P313+P362+P364
  • P332+P313
  • P305+P351+P338+P337+P313
  • P302+P350
  • P337+P313
  • P305+P351+P338
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >350 mg/kg
TOXIC EFFECTS :
   Behavioral - changes in motor activity (specific assay)
   Behavioral - ataxia
   Behavioral - rigidity (including catalepsy)
REFERENCE :
   IJSIDW Indian Journal of Pharmaceutical Sciences.  (Kalina, Santa Cruz
   (East), Bombay 400 029, India)  V.40(2)-    1978-  Volume(issue)/page/year:
   49,77,1987

Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

其他信息

  • 2-硝基肉桂酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 N0356 2-硝基肉桂酸 2-Nitrocinnamic Acid 25G 855元 2014/06/02 N0356 2-硝基肉桂酸 2-Nitrocinnamic Acid 10G 464元 2010/06/21 128620250 2-硝基肉桂酸 o-Nitrocinnamic acid 97%, predominantly trans 25 GR 871元
  • 海关编码:29163900
  • MOL 文件:612-41-9.mol
  • 图谱信息:2-硝基肉桂酸(612-41-9)质谱(MS) 2-硝基肉桂酸(612-41-9)核磁图( 13 CNMR) 2-硝基肉桂酸(612-41-9)核磁图( 1 HNMR) 2-硝基肉桂酸(612-41-9)红外图谱(IR1) 2-硝基肉桂酸(612-41-9)红外图谱(IR2)
  • Acros Organics:邻硝基苯乙烯酸(邻硝基肉桂酸) o-Nitrocinnamic acid, predominantly trans, 97%(612-41-9)
  • 下游产品:5-甲氧基甲基-2,3-吡啶二羧酸
  • MSDS 信息:2-Nitrocinnamic acid(612-41-9).msds
  • Hazard Note:Irritant
  • Sigma Aldrich:612-41-9(sigmaaldrich)
  • TCI Shanghai:2-硝基肉桂酸 2-Nitrocinnamic Acid,>;98.0%(LC)(T)(612-41-9)

系列性分类


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