Methyl 5-Methyl-3-Phenylisoxazole-4-Carboxylate 5-甲基-3-苯基异恶唑-4-羧酸甲酯

CAS 2065-28-3 MFCD00119105

化学结构图

2065-28-3
SMILES: COC(=O)c1c(-c2ccccc2)noc1C

化学属性

Mol. FormulaC12H11NO3
Mol. Weight217.22
Melting Point79-81 °C

别名和识别编码

Chemical NameMethyl 5-Methyl-3-Phenylisoxazole-4-Carboxylate
CAS Number2065-28-3
Alfabeta NameMETHYLMETHYLPHENYLISOXAZOLECARBOXYLATE 534-----
MDL NumberMFCD00119105
Chemical Name Translation5-甲基-3-苯基异恶唑-4-羧酸甲酯
LabNetwork Molecule IDLN00145625
PubChem Substance ID727920
InChIInChI=1S/C12H11NO3/c1-8-10(12(14)15-2)11(13-16-8)9-6-4-3-5-7-9/h3-7H,1-2H3
Synonym Methyl 5-methyl-3-phenylisoxazole-4-carboxylate {LY} Methyl 5-methyl-3-phenylisoxazole-4-carboxylate {} {LY} Methyl 5-methyl-3-phenylisoxazole-4-carboxylate {} {} {LY} Methyl 5-methyl-3-phenylisoxazole-4-carboxylate {} {} {} {LY} Methyl 5-methyl-3-phenylisoxazole-4-carboxylate {} {} {} {} {LY} Methyl 5-methyl-3-phenylisoxazole-4-carboxylate {} {} {} {} {} {} {} {} {} {} {LY} Methyl 5-methyl-3-phenylisoxazole-4-carboxylate {} {} {} {} {} {} {LY} Methyl 5-methyl-3-phenylisoxazole-4-carboxylate {} {} {} {} {} {} {} {LY} Methyl 5-methyl-3-phenylisoxazole-4-carboxylate {} {} {} {} {} {} {} {} {LY} Methyl 5-methyl-3-phenylisoxazole-4-carboxylate {} {} {} {} {} {} {} {} {} {LY} Methyl 5-methyl-3-phenylisoxazole-4-carboxylate {} {} {} {} {} {} {} {} {} {} {LY} Methyl 5-methyl-3-phenylisoxazole-4-carboxylate {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 5-methyl-3-phenylisoxazole-4-carboxylate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 5-methyl-3-phenylisoxazole-4-carbo
Canonical SMILESCC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OC
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分类

  • {KO} Esters

安全信息

Warnings IRRITANT
Storage condition

药物吸收、分布、代谢与排泄(ADME)

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

系列性分类

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