Ethyl 3-(4-methoxyphenyl)-5-methylisoxazole-4-carboxylate

Name: Ethyl 3-(4-methoxyphenyl)-5-methylisoxazole-4-carboxylate
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CAS No. 495417-31-7
Cat. No. CS-0314763
Molecule weight261.27
Purity95+%
MDL No.None

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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Ethyl 3-(4-methoxyphenyl)-5-methylisoxazole-4-carboxylate|CS-0314763

Structure of 495417-31-7

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General Information

CAS No. 495417-31-7
Cat. No. CS-0314763
Purity 95+%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₄H₁₅NO₄
Molecular Weight 261.27
Synonym(s) Ethyl 3-(4-methoxyphenyl)-5-methyl-1,2-oxazole-4-carboxylate
SMILES CCOC(=O)C1=C(C)ON=C1C2=CC=C(C=C2)OC

Synthesis

Route1
- 54716-02-8
- 38435-51-7
- ~65%
- 495417-31-7
References
- Zamponi, Gerald W.; Stotz, Stephanie C.; Staples, Richard J.; Andro, Tina M.; Nelson, Jared K.; Hulubei, Victoria; Blumenfeld, Alex; Natale, Nicholas R. Journal of Medicinal Chemistry, 2003 , vol. 46, # 1 p. 87 - 96
Route2
- In-stock
  
  3717-21-3
- 2723-42-4
- ~%
- 495417-31-7
References
- Nakamura, Masayuki; Kurihara, Hideki; Suzuki, Gentaroh; Mitsuya, Morihiro; Ohkubo, Mitsuru; Ohta, Hisashi Bioorganic and Medicinal Chemistry Letters, 2010 , vol. 20, # 2 p. 726 - 729

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302
Precautionary Statements : P264-P270-P330-P501

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Computational Chemistry Data

TPSA 61.56
LogP 2.83532
H_Acceptors 5
H_Donors 0
Rotatable_Bonds 4

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Isoxazole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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Ethyl 3-(4-methoxyphenyl)-5-methylisoxazole-4-carboxylate

CAS No. 495417-31-7

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