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13215-72-0

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13215-72-0 Structure

13215-72-0 Structure
IdentificationBack Directory
[Name]

1,3-Di(4-carboxyphenyl)benzene
[CAS]

13215-72-0
[Synonyms]

DK7290
1,3-Di(4-carboxyphenyl)benzene
4,4'-(1,3-Phenylene)dibenzoic acid
4-[3-(4-carboxyphenyl)phenyl]benzoic acid
[1,1′:3′,1″-terphenyl]-4,4″-dicarboxylic acid
[1,1':3',1''-Terphenyl]-4,4''-dicarboxylicacid (9CI)
[Molecular Formula]

C20H14O4
[MDL Number]

MFCD30543297
[MOL File]

13215-72-0.mol
[Molecular Weight]

318.32
Chemical PropertiesBack Directory
[Melting point ]

368-370 °C
[Boiling point ]

566.7±43.0 °C(Predicted)
[density ]

1.298±0.06 g/cm3(Predicted)
[storage temp. ]

Store at room temperature
[pka]

3.86±0.10(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C20H14O4/c21-19(22)15-8-4-13(5-9-15)17-2-1-3-18(12-17)14-6-10-16(11-7-14)20(23)24/h1-12H,(H,21,22)(H,23,24)
[InChIKey]

KFHMRRYUOBRPAA-UHFFFAOYSA-N
[SMILES]

C1(C2=CC=CC(C3=CC=C(C(O)=O)C=C3)=C2)=CC=C(C(O)=O)C=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
Hazard InformationBack Directory
[Uses]

1,3-Di(4-carboxyphenyl)benzene can be used as a ligand in the synthesis of MOF materials (JLU-MOF50).
Spectrum DetailBack Directory
[Spectrum Detail]

1,3-Di(4-carboxyphenyl)benzene(13215-72-0)1HNMR
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