2,5-bis-(3,7-Dimethyloctyloxy)terephthalaldehyde

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Product Information

Molecular Formula:
C28H46O4
Molecular Weight:
446.667
Synonyms
2,5-Bis(3,7-dimethyloctyloxy)terephthalaldehyde; 325461-35-6; AC1MTPZP; 2,5-bis(3,7-dimethyloctoxy)terephthalaldehyde; SCHEMBL4430873; CTK8E3523
IUPAC Name
2,5-bis(3,7-dimethyloctoxy)terephthalaldehyde
Canonical SMILES
CC(C)CCCC(C)CCOC1=CC(=C(C=C1C=O)OCCC(C)CCCC(C)C)C=O
InChI
InChI=1S/C28H46O4/c1-21(2)9-7-11-23(5)13-15-31-27-17-26(20-30)28(18-25(27)19-29)32-16-14-24(6)12-8-10-22(3)4/h17-24H,7-16H2,1-6H3
InChI Key
JMACLBZCZVVLDQ-UHFFFAOYSA-N
Melting Point
46.0-48.2°C(lit.)
Purity
95%

Safety Information

Hazards
H315-H319-H335
Precautionary Statement
P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
GHS Pictogram
GHS07
Signal Word
Warning

Computed Properties

XLogP3
9
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
18
Exact Mass
446.33960994
Monoisotopic Mass
446.33960994
Topological Polar Surface Area
52.6
Heavy Atom Count
32
Formal Charge
0
Complexity
446
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
2
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
EP-1074600-A2 Polymeric fluorescent substance and polymer light emitting device 1999-08-03
EP-1074600-B1 Polymeric fluorescent substance and polymer light emitting device 1999-08-03
JP-2001123156-A Polymer fluorescent substance and polymer light emitting device using the same 1999-08-03
JP-2011246716-A Polymer phosphor and polymer light emitting device using the same 1999-08-03
JP-4830186-B2 Polymer phosphor and polymer light emitting device using the same 1999-08-03
JP-5257489-B2 Polymer phosphor and polymer light emitting device using the same 1999-08-03
KR-100887163-B1 Polymer phosphor and polymer light emitting device using same 1999-08-03
KR-20010021172-A Polymeric fluorescent substance and polymer light emitting device 1999-08-03
TW-484341-B Polymeric fluorescent substance and polymer light emitting device 1999-08-03
US-6984459-B1 Polymeric fluorescent substance and polymer light emitting device 1999-08-03
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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