5-Thiazoleacetic acid, 4-(4-chlorophenyl)-2-phenyl-, calcium salt (2:1)
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5-Thiazoleacetic acid, 4-(4-chlorophenyl)-2-phenyl-, calcium salt (2:1)
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CAS No:
85721-24-0
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Formula:
C17H12ClNO2S.1/2Ca
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Chemical Name:
5-Thiazoleacetic acid, 4-(4-chlorophenyl)-2-phenyl-, calcium salt (2:1)
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Synonyms:
5-Thiazoleacetic acid,4-(4-chlorophenyl)-2-phenyl-,calcium salt (2:1);5-Thiazoleacetic acid,4-(4-chlorophenyl)-2-phenyl-,calcium salt
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CAS No:
5-Thiazoleacetic acid, 4-(4-chlorophenyl)-2-phenyl-, calcium salt (2:1) Basic Attributes
697.66348
696.002
288-435-4
87K2GQ2Q21
DTXSID80235035
Characteristics
163
Oral-rat LD50: 860 mg/kg; Oral-Mouse LD50: 1353 mg/kg
Thermal decomposition emits toxic sulfur oxides, nitrogen oxides, chloride fumes
Computed Properties
Molecular Weight:697.7
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:696.0023958
Monoisotopic Mass:696.0023958
Topological Polar Surface Area:163
Heavy Atom Count:45
Complexity:375
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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5-Thiazoleacetic acid, 4-(4-chlorophenyl)-2-phenyl-, calcium salt (2:1)
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