3-(5-Chloro-2-thienyl)-5-methyl-4-isoxazolecarboxylic acid
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3-(5-Chloro-2-thienyl)-5-methyl-4-isoxazolecarboxylic acid
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CAS No:
14345-96-1
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Formula:
C9H6ClNO3S
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Chemical Name:
3-(5-Chloro-2-thienyl)-5-methyl-4-isoxazolecarboxylic acid
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Synonyms:
4-Isoxazolecarboxylic acid,3-(5-chloro-2-thienyl)-5-methyl-;3-(5-Chloro-2-thienyl)-5-methyl-4-isoxazolecarboxylic acid
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CAS No:
3-(5-Chloro-2-thienyl)-5-methyl-4-isoxazolecarboxylic acid Basic Attributes
243.66684
243.67
238-295-5
DTXSID90162424
2934999090
Characteristics
91.6
2.6
1.513g/cm3
158-159 °C
386.2ºC at 760mmHg
187.3ºC
1.616
1.18E-06mmHg at 25°C
Computed Properties
Molecular Weight:243.67
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:242.9756919
Monoisotopic Mass:242.9756919
Topological Polar Surface Area:91.6
Heavy Atom Count:15
Complexity:266
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-(5-Chloro-2-thienyl)-5-methyl-4-isoxazolecarboxylic acid
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