2-pyridin-3-yl-4,5-dihydro-1,3-thiazole-4-carboxylic acid
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2-pyridin-3-yl-4,5-dihydro-1,3-thiazole-4-carboxylic acid
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CAS No:
116247-03-1
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Formula:
C9H8N2O2S
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Chemical Name:
2-pyridin-3-yl-4,5-dihydro-1,3-thiazole-4-carboxylic acid
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Synonyms:
2-Pyridin-3-yl-4,5-dihydro-thiazole-4-carboxylic acid; 2-Pyrid-3-yl-4,5-dihydro-1,3-thiazole-4-carboxylic acid;
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CAS No:
2-pyridin-3-yl-4,5-dihydro-1,3-thiazole-4-carboxylic acid Basic Attributes
208.23700
208.03064868
DTXSID30389618
2934100090
Characteristics
87.85000
0.46380
1.49g/cm3
180ºC
452.1ºC at 760mmHg
227.2ºC
1.714
5.83E-09mmHg at 25°C
Computed Properties
Molecular Weight:208.24
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:208.03064868
Monoisotopic Mass:208.03064868
Topological Polar Surface Area:87.8
Heavy Atom Count:14
Complexity:268
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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