Ethyl 4'-methoxy[1,1'-biphenyl]-4-carboxylate 4-甲氧基-4-连苯基羧酸乙酯

CAS 732-80-9 MFCD00671953

化学结构图

732-80-9
SMILES: CCOC(=O)c1ccc(-c2ccc(OC)cc2)cc1

化学属性

Mol. FormulaC16H16O3
Mol. Weight256.30
Melting Point102-108 °C

别名和识别编码

Chemical NameEthyl 4’-Methoxy-[1,1’-Biphenyl]-4-Carboxylate
CAS Number732-80-9
Alfabeta NameETHYLMETHOXYBIPHENYLCARBOXYLATE 4114[]----,''
MDL NumberMFCD00671953
Synonym Ethyl 4'-methoxybiphenyl-4-carboxylate {LY} Ethyl 4'-methoxybiphenyl-4-carboxylate {} {LY} Ethyl 4'-methoxybiphenyl-4-carboxylate {} {} {LY} Ethyl 4'-methoxybiphenyl-4-carboxylate {} {} {} {LY} Ethyl 4'-methoxybiphenyl-4-carboxylate {} {} {} {} {LY} Ethyl 4'-methoxybiphenyl-4-carboxylate {} {} {} {} {} {LY} Ethyl 4'-methoxybiphenyl-4-carboxylate {} {} {} {} {} {} {LY} Ethyl 4'-methoxybiphenyl-4-carboxylate {} {} {} {} {} {} {} {LY} Ethyl 4'-methoxybiphenyl-4-carboxylate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 4'-methoxybiphenyl-4-carboxylate {} {} {} {} {} {} {} {} {} {LY} Ethyl 4'-methoxybiphenyl-4-carboxylate {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 4'-methoxybiphenyl-4-carboxylate {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 4'-methoxybiphenyl-4-carboxylate {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 4'-methoxybiphenyl-4-carboxylate {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 4'-methoxybiphenyl-4
PubChem Substance ID2764348
Chemical Name Translation4-甲氧基-4-连苯基羧酸乙酯
LabNetwork Molecule IDLN00148536
InChIInChI=1S/C16H16O3/c1-3-19-16(17)14-6-4-12(5-7-14)13-8-10-15(18-2)11-9-13/h4-11H,3H2,1-2H3
Canonical SMILESO=C(OCC)C1=CC=C(C=C1)C=2C=CC(OC)=CC2
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分类

  • {SNA} Building Blocks, C12 to C63, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks
  • {KO} Esters

相关文献及参考

  • Short: IV/7a Title: Liquid Crystals: One-Ring Systems and Two-Ring Systems without Bridging Groups Author: Vill, V. Editor: Thiem, J. Source: Landolt-Börnstein, New Series Volume: IV/7a Year: 1992 Keyword: organic compounds; enthaly of fusion; melting point; phase transition; liquid crystals; glass transition ISBN: 3-540-55503-X ISBN: 978-3-540-55503-2 Internet Resource: DOI:10.1007/b46098 RefComment: 10 figs., VIII, 268 pages.

安全信息

Warnings IRRITANT
WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Hazard Codes Xi
Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

药物吸收、分布、代谢与排泄(ADME)

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

其他信息

  • MOL 文件:732-80-9.mol
  • Hazard Note:Irritant
  • Sigma Aldrich:732-80-9(sigmaaldrich)

系列性分类


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