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{[4-(4-Methoxyphenyl)-6-methyl-2-pyrimidinyl]sulfanyl}(phenyl)acetic acid
[CAS# 87125-99-3]

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Identification
Name {[4-(4-Methoxyphenyl)-6-methyl-2-pyrimidinyl]sulfanyl}(phenyl)acetic acid
Synonyms {[4-(4-methoxyphenyl)-6-methyl-2-pyrimidinyl]thio}(phenyl)acetic acid; 2-Pyrimidinethioacetic acid, 4-(4-methoxyphenyl)-6-methyl-β-phenyl
Molecular Structure CAS#: 87125-99-3, {[4-(4-Methoxyphenyl)-6-methyl-2-pyrimidinyl]sulfanyl}(phenyl)acetic acid
Molecular Formula C20H18N2O3S
Molecular Weight 366.43
CAS Registry Number 87125-99-3
SMILES O=C(O)C(Sc1nc(cc(n1)C)c2ccc(OC)cc2)c3ccccc3
InChI 1S/C20H18N2O3S/c1-13-12-17(14-8-10-16(25-2)11-9-14)22-20(21-13)26-18(19(23)24)15-6-4-3-5-7-15/h3-12,18H,1-2H3,(H,23,24)
InChIKey OAPBYYJLNHQZCG-UHFFFAOYSA-N
Properties
Density 1.334g/cm3 (Cal.)
Boiling point 561.432°C at 760 mmHg (Cal.)
Flash point 293.344°C (Cal.)
Market Analysis Reports
List of Reports Available for {[4-(4-Methoxyphenyl)-6-methyl-2-pyrimidinyl]sulfanyl}(phenyl)acetic acid
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