1,2-Benzisoxazole-3-methanol, alpha-(phenylthio)-, 3-acetate

Base Information

Chemical Name:1,2-Benzisoxazole-3-methanol, alpha-(phenylthio)-, 3-acetate
CAS No.:84395-94-8
Molecular Formula:C₁₆H₁₃NO₃S
Molecular Weight:299.35
Hs Code.:
DSSTox Substance ID:DTXSID401202639

Synonyms:DTXSID401202639;1,2-Benzisoxazole-3-methanol, alpha-(phenylthio)-, 3-acetate;84395-94-8

Suppliers and Price of 1,2-Benzisoxazole-3-methanol, alpha-(phenylthio)-, 3-acetate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 1,2-Benzisoxazole-3-methanol, alpha-(phenylthio)-, 3-acetate

Chemical Property:

XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:299.06161445
Heavy Atom Count:21
Complexity:359

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(=O)OC(C1=NOC2=CC=CC=C21)SC3=CC=CC=C3

Technology Process of 1,2-Benzisoxazole-3-methanol, alpha-(phenylthio)-, 3-acetate

There total 1 articles about 1,2-Benzisoxazole-3-methanol, alpha-(phenylthio)-, 3-acetate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 108-24-7
acetic anhydride

: 82897-94-7
(1,2-benzisoxazol-3-yl)methyl phenyl sulfoxide

: 84395-94-8
(1,2-benzisoxazol-3-yl)(phenylthio)methyl acetate

Guidance literature:: for 3.5h; Heating;
DOI:10.1248/cpb.30.2820

Reference yield:

: 84395-94-8
(1,2-benzisoxazol-3-yl)(phenylthio)methyl acetate

: 84395-93-7
1,2-benzisoxazole-3-carboxaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: 3.9 g / I₂ / 24 h / Heating

2: 2.1 g / 20percent aq. HCl / 1 h / Ambient temperature

With hydrogenchloride; iodine;
DOI:10.1248/cpb.30.2820