5-Cyclopropyl-4-isoxazolecarboxylic acid
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5-Cyclopropyl-4-isoxazolecarboxylic acid
structure -
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CAS No:
124845-04-1
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Formula:
C7H7NO3
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Chemical Name:
5-Cyclopropyl-4-isoxazolecarboxylic acid
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Synonyms:
4-Isoxazolecarboxylic acid,5-cyclopropyl-;5-Cyclopropyl-4-isoxazolecarboxylic acid;5-Cyclopropylisoxazole-4-carboxylic acid
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CAS No:
Characteristics
63.33000
0.81
1.4±0.1 g/cm3
163-165 °C @ Solvent: Acetonitrile
317.6±30.0 °C at 760 mmHg
145.9±24.6 °C
1.587
0.000159mmHg at 25°C
Safety Information
3
22
Xn
P264, P270, P301+P312, P330, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 39 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:153.14
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:153.042593085
Monoisotopic Mass:153.042593085
Topological Polar Surface Area:63.3
Heavy Atom Count:11
Complexity:179
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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5-Cyclopropyl-4-isoxazolecarboxylic acid
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