CAS
57764-44-0 Purity
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57764-44-0 Purity
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Ethyl 1,2-benzisoxazole-3-carboxylate
CAS
57764-49-5
Catalog Number
ACM57764495
Category
Other Products
Molecular Weight
191.18
Molecular Formula
C10H9NO3
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- Product Description
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- Synthetic Use
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Specification
Synonyms
Ethyl 1,2-benzisoxazole-3-carboxylate;Ethyl benzo[d]isoxazole-3-carboxylate
IUPAC Name
ethyl 1,2-benzoxazole-3-carboxylate
Canonical SMILES
CCOC(=O)C1=NOC2=CC=CC=C21
InChI Key
IRTACBSCHHOIPA-UHFFFAOYSA-N
Boiling Point
307ºC at 760 mmHg
Melting Point
59ºC
Flash Point
139.5ºC
Density
1.241g/cm³
Exact Mass
191.05800
H-Bond Acceptor
4
H-Bond Donor
0
Upstream Synthesis Route 1
- 651780-27-7
- 57764-49-5
Reference: [1] Patent: WO2005/63767, 2005, A2, . Location in patent: Page/Page column 44-45
Upstream Synthesis Route 2
- 57764-48-4
- 57764-49-5
Reference: [1] Patent: WO2006/69063, 2006, A1, . Location in patent: Page/Page column 88-89
Upstream Synthesis Route 3
- 57764-48-4
- 57764-49-5
Reference: [1]Patent: EP3456711,2019,A1 .Location in patent: Paragraph 0300; 0303
Downstream Synthesis Route 1
- 57764-49-5
- 28691-47-6
Reference: [1] Patent: EP1346982, 2003, A1,
Downstream Synthesis Route 2
- 57764-49-5
- 28691-47-6
Reference: [1]Patent: EP1346982,2003,A1
Downstream Synthesis Route 3
- 109-83-1
- 57764-49-5
- 145759-70-2
Reference: [1]Journal of Medicinal Chemistry,1994,vol. 37,p. 2308 - 2314
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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