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2-Hydroxy-3,6,7,10,11-pentakis(hexyloxy)triphenylene

Catalog Number
ACM156244983
Product Name
2-Hydroxy-3,6,7,10,11-pentakis(hexyloxy)triphenylene
CAS
156244-98-3
Category
Small Molecule Semiconductor Building Blocks
Synonyms
3,6,7,10,11-Pentakis(hexyloxy)triphenylen-2-ol
IUPAC Name
3,6,7,10,11-pentahexoxytriphenylen-2-ol
Molecular Weight
745.10
Molecular Formula
C48H72O6
Canonical SMILES
CCCCCCOC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OCCCCCC)OCCCCCC)OCCCCCC)OCCCCCC)O
InChI
InChI=1S/C48H72O6/c1-6-11-16-21-26-50-44-32-38-37(31-43(44)49)39-33-45(51-27-22-17-12-7-2)47(53-29-24-19-14-9-4)35-41(39)42-36-48(54-30-25-20-15-10-5)46(34-40(38)42)52-28-23-18-13-8-3/h31-36,49H,6-30H2,1-5H3
InChI Key
IUYYUSKHZOXORT-UHFFFAOYSA-N
Melting Point
50 °C
Purity
>96.0%(HPLC)
Density
Air Sensitive
Appearance
White to Light gray to Light yellow powder to crystal
Storage
Store under inert gas
Complexity
916
Covalently-Bonded Unit Count
1
Exact Mass
744.53289g/mol
Formal Charge
0
Heavy Atom Count
54
Monoisotopic Mass
744.53289g/mol
Rotatable Bond Count
30
XLogP3
16
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