1,1',1'',1'''-(1,2-Ethenediylidene)tetrakis(4-methoxybenzene)
Basic information
- CAS
10019-24-6- Standard SMILES
COc1ccc(C(=C(c2ccc(OC)cc2)c2ccc(OC)cc2)c2ccc(OC)cc2)cc1- InChIKey
LXYBRRVOIQFRRL-UHFFFAOYSA-N- Molecular formula
- C30H28O4
- Average molar mass
- 452.5 g/mol
- Monoisotopic mass
- 452.19875937
Overview
structure
Names & identifiers
- Preferred name
- 1,1',1'',1'''-(1,2-Ethenediylidene)tetrakis(4-methoxybenzene)
- IUPAC
- 1-methoxy-4-[1,2,2-tris(4-methoxyphenyl)ethenyl]benzene
- English name
- 1,1,2,2-Tetra(4-methoxyphenyl)ethene
- Molecular formula
- C30H28O4
- Molecular weight
- 452.54
Names & synonyms
10019-24-6Tetrakis(4-methoxyphenyl)ethyleneTetrakis(p-methoxyphenyl)ethyleneDTXSID00142999RefChem:906529DTXCID40654901,1',1'',1'''-(1,2-Ethenediylidene)tetrakis(4-methoxybenzene)1,1,2,2-Tetrakis(4-methoxyphenyl)etheneTetra-p-anisylethylene1-methoxy-4-[1,2,2-tris(4-methoxyphenyl)ethenyl]benzeneEthylene, tetrakis(p-methoxyphenyl)-MFCD00185484
Show more names
Tetrakis(4-methoxyphenyl)ethene1,1,2,2-tetrakis(4-methoxyphenyl)ethylene1,1,2,2-Tetrakis(4-methoxyphenyl)ethene - [T94018]1,1',1'',1'''-(1,2-ethenediylidene)tetrakis[4-methoxy-BenzeneBenzene,1,1',1'',1'''-(1,2-ethenediylidene)tetrakis[4-methoxy-
1,1,2,2-Tetra(4-methoxyphenyl)etheneBenzene, 1,1',1'',1'''-(1,2-ethenediylidene)tetrakis[4-methoxy-NSC1321241-methoxy-4-[1,2,2-tris(4-methoxyphenyl)vinyl]benzeneBenzene, 1,1',1'',1'''-(1,2-ethenediylidene)tetrakis(4-methoxy-Tetra-anisylethylene1-Methoxy-4-(1,2,2-tris(4-methoxyphenyl)vinyl)benzeneNSC 132124
Properties
Computed structural properties
- XLogP
- 7.8
- Topological polar surface area
- 36.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 508
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Physicochemical properties
- Melting point
- 183 °C · 183 °C
- Boiling point
- 574.1 · 574.1±45.0 °C(Predicted)
- Density
- 1.126 · 1.126±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- Appearance
- White to off-white Solid
- InChI
- InChI=1S/C30H28O4/c1-31-25-13-5-21(6-14-25)29(22-7-15-26(32-2)16-8-22)30(23-9-17-27(33-3)18-10-23)24-11-19-28(34-4)20-12-24/h5-20H,1-4H3
- InChIKey
- LXYBRRVOIQFRRL-UHFFFAOYSA-N
- SMILES
- C(/C1=CC=C(OC)C=C1)(\C1=CC=C(OC)C=C1)=C(\C1=CC=C(OC)C=C1)/C1=CC=C(OC)C=C1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses1,1,2,2-Tetra(4-methoxyphenyl)ethene is used as an intermediate for the synthesis of MOF material ligands.
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Compound notes
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