4-chloro-1,2,5-thiadiazole-3-carboxylic acid
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4-chloro-1,2,5-thiadiazole-3-carboxylic acid
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CAS No:
5097-44-9
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Formula:
C3HClN2O2S
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Chemical Name:
4-chloro-1,2,5-thiadiazole-3-carboxylic acid
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Synonyms:
4-chloro-1,2,5-Thiadiazole-3-carboxylic acid;OC(=O)C1=NSN=C1Cl;SCHEMBL16389627;ZINC258552483;DA-39762;CS-0101209;FT-0729663
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CAS No:
Computed Properties
Molecular Weight:164.57
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:163.9447261
Monoisotopic Mass:163.9447261
Topological Polar Surface Area:91.3
Heavy Atom Count:9
Complexity:133
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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