CAS
61975-33-5 Purity
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61975-33-5 Purity
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1,2-Benzisoxazol-3(2H)-one,6-chloro-
CAS
61977-29-5
Catalog Number
ACM61977295
Category
Other Products
Molecular Weight
169.57
Molecular Formula
C7H4ClNO2
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Specification
Synonyms
6-CHLOROBENZO[D]ISOXAZOL-3-OL;6-CHLORO-3-HYDROXY-1,2-BENZISOXAZOLE;6-Chlorobenzo[d]isoxazol-3-ol 97%;6-CHLORO-3-HYDROXYBENZISOXAZOLE
IUPAC Name
6-chloro-1,2-benzoxazol-3-one
Canonical SMILES
C1=CC2=C(C=C1Cl)ONC2=O
InChI Key
SJAPSPJRTQCDNO-UHFFFAOYSA-N
Boiling Point
336.7ºC at 760 mmHg
Melting Point
218-220ºC
Flash Point
157.4ºC
Density
1.486 g/cm³
Appearance
gray solid
Exact Mass
168.99300
Hazard Statements
Xi
H-Bond Acceptor
2
H-Bond Donor
1
Safety Description
26-36/37/39
Upstream Synthesis Route 1
- 61799-78-8
- 61977-29-5
Reference: [1]Kalkote,U.R.; Goswami,D.D.
[Australian Journal of Chemistry, 1977, vol. 30, p. 1847 - 1850]
Downstream Synthesis Route 1
- 61977-29-5
- 16263-54-0
Reference: [1] Patent: EP2322520, 2011, A1, . Location in patent: Page/Page column 12
Downstream Synthesis Route 2
- 61977-29-5
- 16263-54-0
Reference: [1] Journal of Medicinal Chemistry, 1986, vol. 29, # 3, p. 359 - 369
Downstream Synthesis Route 3
- 61977-29-5
- 16263-54-0
Reference: [1]Patent: EP2322520,2011,A1 .Location in patent: Page/Page column 12
Downstream Synthesis Route 4
- 61977-29-5
- 16263-54-0
Reference: [1]Journal of Medicinal Chemistry,1986,vol. 29,p. 359 - 369
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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