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Merck
CN

658405

(S)-4-(4-氨基苄基)-1,3-唑烷-2-酮

97%

别名:

(4S)-4-[(4-氨基苯基)甲基]-2-恶唑烷酮

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关于此项目

经验公式(希尔记法):
C10H12N2O2
化学文摘社编号:
分子量:
192.21
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352005
MDL number:
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产品名称

(S)-4-(4-氨基苄基)-1,3-唑烷-2-酮, 97%

InChI

1S/C10H12N2O2/c11-8-3-1-7(2-4-8)5-9-6-14-10(13)12-9/h1-4,9H,5-6,11H2,(H,12,13)/t9-/m0/s1

SMILES string

Nc1ccc(C[C@H]2COC(=O)N2)cc1

InChI key

WNAVSKJKDPLWBD-VIFPVBQESA-N

assay

97%

form

solid

mp

107-111 °C

Quality Level

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Application

(S)-4-(4-Aminobenzyl)-2(1H)-oxazolidinone can be used as a starting material in the synthesis of:
  • Oxazolidinone derived 2-azetidinones as metal cation sensors.
  • Serotonin receptor agonist named zolmitriptan.
  • Schiff base derived zinc metal complexes of biological importance.

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

存储类别

11 - Combustible Solids

wgk

WGK 2

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

法规信息

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分析证书(COA)

Lot/Batch Number

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访问文档库

(S)-4-(4-aminobenzyl)-2-oxazolidinone based 2-azetidinones for antimicrobial application and luminescent sensing of divalent metal cations
Baruah S, et al.
Journal of Heterocyclic Chemistry, 57, 2498?2511-2498?2511 (2020)
Novel zinc (II) complexes of heterocyclic ligands as antimicrobial agents: synthesis, characterisation, and antimicrobial studies
Yamgar RS, et al.
Bioinorganic Chemistry and Applications, 2014 (2014)
Convenient and Industrially Viable Process for Preparation of Zolmitriptan
Neelakandan K, et al.
Journal of Heterocyclic Chemistry, 51(S1), E332-E334 (2014)
D Manikandan et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 239, 118484-118484 (2020-05-30)
The experimental geometry (XRD), vibrational (IR and Raman), electronic (UV-visible) and NMR spectra of (S)-4-(4-Amino-benzyl)-oxazolidin-2-one (ABO) have been corroborated with the corresponding first principle calculated values at DFT using hybrid B3LYP exchange correlation functional invoking 6-311++g(d, p) basis set. The

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