Structure

5-AMINO-3-PHENYLISOXAZOLE

CAS
4369-55-5
Catalog Number
ACM4369555
Category
Other Products
Molecular Weight
160.17
Molecular Formula
C9H8N2O

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  • Synthetic Use
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Specification

Synonyms
5-Amino-3-phenylisoxazole, 3-phenyl-5-isoxazolamine, 3-phenylisoxazol-5-amine, 5-Isoxazolamine, 3-phenyl-, 644978_ALDRICH, Isoxazole, 5-amino-3-phenyl-, 3-phenyl-1,2-oxazol-5-amine, ALBB-006059, NSC93157, CID261201, STK350764, ZINC00333972, U 10776, AI-031/31962041, T5501898, ISOXAZOLE, 5-AMINO-3-PHENYL UPJOHN U-10776, 4369-55-5
IUPAC Name
3-phenyl-1,2-oxazol-5-amine
SMILES
C1=CC=C(C=C1)C2=NOC(=C2)N
InChI Key
HLOHVVZZMMMDMM-UHFFFAOYSA-N
Boiling Point
379.3ºC at 760mmHg
Melting Point
110-114ºC(lit.)
Flash Point
183.2ºC
Density
1.204g/cm³
Exact Mass
160.06400
Hazard Statements
Xn: Harmful;Xi: Irritant;
H-Bond Acceptor
3
H-Bond Donor
1
WGK Germany
3

Upstream Synthesis Route 1

  • 614-16-4
  • 4369-55-5

Reference: [1] Bioorganic and Medicinal Chemistry, 2017, vol. 25, # 6, p. 1914 - 1925

Upstream Synthesis Route 2

  • 935-02-4
  • 4369-55-5

Reference: [1] Tetrahedron Letters, 2018, vol. 59, # 52, p. 4622 - 4625
[2] Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, 1907, vol. 144, p. 1281[3] Bulletin de la Societe Chimique de France, 1907, vol. <4> 1, p. 1092,1093

Upstream Synthesis Route 3

  • 75-05-8
  • 934-16-7
  • 4369-55-5

Reference: [1] Organic Letters, 2006, vol. 8, # 17, p. 3679 - 3680

Downstream Synthesis Route 1

  • 64-18-6
  • 4369-55-5
  • 86685-13-4

Reference: [1]Chemical and Pharmaceutical Bulletin,1986,vol. 34,p. 1643 - 1655
[2]Journal of the Chemical Society,1954,p. 665,668

Downstream Synthesis Route 2

  • 4369-55-5
  • 108-24-7
  • 31301-40-3

Reference: [1]Chemische Berichte,1934,vol. 67,p. 638,644
[2]Chemical and Pharmaceutical Bulletin,1986,vol. 34,p. 1643 - 1655

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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