Methyl 4’-Bromobiphenyl-4-Carboxylate 4’-溴-[1,1’-联苯]-4-甲酸甲酯

CAS 89901-03-1 MFCD00496638

化学结构图

89901-03-1
SMILES: COC(=O)C1C=CC(=CC=1)C1C=CC(Br)=CC=1

化学属性

Mol. FormulaC14H11BrO2
Mol. Weight291.14
Melting Point140-146 °C
TSCANo

别名和识别编码

Chemical NameMethyl 4’-Bromobiphenyl-4-Carboxylate
CAS Number89901-03-1
Alfabeta NameMETHYLBROMOBIPHENYLCARBOXYLATE 4114[]----,''
MDL NumberMFCD00496638
Synonym 4'-Bromobiphenyl-4-carboxylic acid methyl ester Methyl 4-(4-bromophenyl)benzoate
PubChem Substance ID329763914
Chemical Name Translation4’-溴-[1,1’-联苯]-4-甲酸甲酯
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分类

  • {SNA} Aryl, Building Blocks, C12 to C63, C13 to C37+, Carbonyl Compounds, Chemical Synthesis, Esters, Halogenated Hydrocarbons, Organic Building Blocks
  • {KO} ReacBromides
  • {KO} Esters

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany2
Precautionary statements
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • P273 Avoid release to the environment. 避免释放到环境中。
  • 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
Hazard statements
  • H410 Verytoxictoaquaticlifewithlonglastingeffects 对水生生物毒性非常大并具有长期影响。
  • H318 Causes serious eye damage 严重伤害眼睛
Signal word Danger
Hazard Codes Xi,N
Safety Statements
  • S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置；
  • S61 Avoid release to the environment. Refer to special instructions/safety data sheet 避免释放到环境中，参考特别指示/安全收据说明书；
  • 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；
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置；
Risk Statements
  • R50/53
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Acceptors
2
Rotatable Bonds
3
H-bond Donors
0
LogP
4

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Esters - Carbonyl Compounds
  6. C12 to C63 - Esters

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