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3,3'-Bi[1,4]benzoxazino[2,3,4-kl]phenoxazine

Catalog Number
ACM1395881589-1
Product Name
3,3'-Bi[1,4]benzoxazino[2,3,4-kl]phenoxazine
CAS
1395881-58-9
Category
Organic Light-Emitting Diode (OLED) Materials
Synonyms
HN-D2
IUPAC Name
5-(8,14-dioxa-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaen-5-yl)-8,14-dioxa-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaene
Molecular Weight
544.57
Molecular Formula
C36H20N2O4
Canonical SMILES
C1=CC=C2C(=C1)N3C4=C(C=C(C=C4)C5=CC6=C(C=C5)N7C8=CC=CC=C8OC9=C7C(=CC=C9)O6)OC1=CC=CC(=C13)O2
InChI
InChI=1S/C36H20N2O4/c1-3-9-27-23(7-1)37-25-17-15-21(19-33(25)41-31-13-5-11-29(39-27)35(31)37)22-16-18-26-34(20-22)42-32-14-6-12-30-36(32)38(26)24-8-2-4-10-28(24)40-30/h1-20H
InChI Key
QKKFYYGKAXHDOK-UHFFFAOYSA-N
Boiling Point
340 °C
Melting Point
340 °C
Purity
95%+
Appearance
Light orange to Yellow to Green powder to crystal
Storage
Keep in dark place.
Complexity
933
Covalently-Bonded Unit Count
1
Exact Mass
544.142307g/mol
Formal Charge
0
Heavy Atom Count
42
Monoisotopic Mass
544.142307g/mol
Rotatable Bond Count
1
XLogP3
8.5
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