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171820-04-5

171820-04-5 Structure

171820-04-5 Structure
IdentificationBack Directory
[Name]

4,6-Di(4-carboxyphenyl)pyrimidine
[CAS]

171820-04-5
[Synonyms]

3,5-Di(4-carboxyphenyl)pyridine
4,6-Di(4-carboxyphenyl)pyrimidine
4,4'-(3,5-pyridinediyl)bis-Benzoic acid
Benzoic acid, 4,4'-(3,5-pyridinediyl)bis-
[Molecular Formula]

C19H13NO4
[MDL Number]

MFCD29919308
[MOL File]

171820-04-5.mol
[Molecular Weight]

319.31
Chemical PropertiesBack Directory
[Boiling point ]

587.2±50.0 °C(Predicted)
[density ]

1.340±0.06 g/cm3(Predicted)
[pka]

3.29±0.10(Predicted)
[InChI]

InChI=1S/C19H13NO4/c21-18(22)14-5-1-12(2-6-14)16-9-17(11-20-10-16)13-3-7-15(8-4-13)19(23)24/h1-11H,(H,21,22)(H,23,24)
[InChIKey]

NAHCDCCKLFXYIF-UHFFFAOYSA-N
[SMILES]

C1=NC=C(C2=CC=C(C=C2)C(O)=O)C=C1C1=CC=C(C=C1)C(O)=O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P280-P301+P312-P302+P352-P305+P351+P338
Questions And AnswerBack Directory
[Application]

3,5-Di(4-carboxyphenyl)pyridine can be used as an organic synthesis intermediate and a pharmaceutical intermediate, mainly in laboratory research and development processes and chemical and pharmaceutical production processes.
Spectrum DetailBack Directory
[Spectrum Detail]

4,6-Di(4-carboxyphenyl)pyrimidine(171820-04-5)1HNMR
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