2-ETHYL-4-METHYL THIAZOLE-5-CARBOXYLIC ACID
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2-ETHYL-4-METHYL THIAZOLE-5-CARBOXYLIC ACID
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CAS No:
113366-46-4
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Formula:
C7H9NO2S
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Chemical Name:
2-ETHYL-4-METHYL THIAZOLE-5-CARBOXYLIC ACID
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Synonyms:
2-ethyl-4-methyl-1,3-thiazole-5-carboxylic acid;5-Thiazolecarboxylicacid, 2-ethyl-4-methyl-;2-Ethyl-4-methylthiazole-5-carboxylic acid;ACMC-1BREM;SCHEMBL9642790;CTK0H2933;DTXSID40550756;MFCD08458316;ZINC19091417;AKOS009328336
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CAS No:
2-ETHYL-4-METHYL THIAZOLE-5-CARBOXYLIC ACID Basic Attributes
171.22
171.03500
DTXSID40550756
2934100090
Characteristics
78.4
1.71210
1.280±0.06 g/cm3(Predicted)
313.5±22.0 °C(Predicted)
143.4ºC
1.572
0.000211mmHg at 25°C
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:171.22
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:171.03539970
Monoisotopic Mass:171.03539970
Topological Polar Surface Area:78.4
Heavy Atom Count:11
Complexity:163
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-ETHYL-4-METHYL THIAZOLE-5-CARBOXYLIC ACID
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