2,3,6,7,10,11-Hexakis(hexyloxy)triphenylene
Catalog Number
ACM70351869
CAS
70351-86-9
IUPAC Name
2,3,6,7,10,11-hexahexoxytriphenylene
Molecular Weight
829.26
Molecular Formula
C54H84O6
Product Information
Canonical SMILES
CCCCCCOC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OCCCCCC)OCCCCCC)OCCCCCC)OCCCCCC)OCCCCCC
Inchi
InChI=1S/C54H84O6/c1-7-13-19-25-31-55-49-37-43-44(38-50(49)56-32-26-20-14-8-2)46-40-52(58-34-28-22-16-10-4)54(60-36-30-24-18-12-6)42-48(46)47-41-53(59-35-29-23-17-11-5)51(39-45(43)47)57-33-27-21-15-9-3/h37-42H,7-36H2,1-6H3
InChIKey
SQYCPYUKCAKHRN-UHFFFAOYSA-N
Melting Point
180 °C
Purity
>98.0%(HPLC)
Appearance
White to Almost white powder to crystal
Complexity
807
Heavy Atom Count
60
MDL Number
MFCD16250223
Reaxys Registry Number
2320364
Rotatable Bond Count
36
Monoisotopic Mass
828.62679g/mol
Exact Mass
828.62679g/mol
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