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Ethanone,1-(3-chloro-5-isoxazolyl)-(9CI)

Ethanone,1-(3-chloro-5-isoxazolyl)-(9CI) structure

CAS No:
80403-94-7
Formula:
C5H4ClNO2
Chemical Name:
Ethanone,1-(3-chloro-5-isoxazolyl)-(9CI)
Synonyms:
1-(3-chloroisoxazol-5-yl)ethanone;3-chloro-5-acetylisoxazole;SCHEMBL10517106;1-(3-CHLORO-1,2-OXAZOL-5-YL)ETHANONE

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Ethanone,1-(3-chloro-5-isoxazolyl)-(9CI) Basic Attributes

Molecular Weight：

145.54376

Exact Mass：

144.993

Characteristics

PSA：

43.1

XLogP3：

1.3

Density：

1.336±0.06 g/cm3(Predicted)

Melting Point：

63-64 °C(Solv: hexane (110-54-3))

Computed Properties

Molecular Weight:145.54
XLogP3:1.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:144.9930561
Monoisotopic Mass:144.9930561
Topological Polar Surface Area:43.1
Heavy Atom Count:9
Complexity:128
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Ethanone,1-(3-chloro-5-isoxazolyl)-(9CI)

Basic Attributes
Characteristics
Computed Properties

Ethanone,1-(3-chloro-5-isoxazolyl)-(9CI)

SDS

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