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5-PHENYLISOXAZOLE-3-CARBONYLCHLORIDE

5-PHENYLISOXAZOLE-3-CARBONYLCHLORIDE structure

CAS No:
78189-50-1
Formula:
C10H6ClNO2
Chemical Name:
5-PHENYLISOXAZOLE-3-CARBONYLCHLORIDE
Synonyms:
5-PHENYLISOXAZOLE-3-CARBONYL CHLORIDE;3-Isoxazolecarbonyl chloride, 5-phenyl- (9CI);5-phenyl-1,2-oxazol-3-carbonyl chloride;3-Isoxazolecarbonylchloride, 5-phenyl-

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5-PHENYLISOXAZOLE-3-CARBONYLCHLORIDE Basic Attributes

Molecular Weight：

207.61

Exact Mass：

207.0087061

DSSTox ID：

DTXSID50428174

Characteristics

Density：

1.321±0.06 g/cm3

Melting Point：

86 °C

Boiling Point：

370.2±30.0 °C(Predicted)

PKA：

-7.72±0.28

Safety Information

Hazard category：

IRRITANT

GHS Classification：

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:207.61
XLogP3:3.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:207.0087061
Monoisotopic Mass:207.0087061
Topological Polar Surface Area:43.1
Heavy Atom Count:14
Complexity:216
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-PHENYLISOXAZOLE-3-CARBONYLCHLORIDE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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