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9,9'-Diphenyl-9H,9'H-3,3'-bicarbazole

Catalog Number
ACM57102622-1
CAS Number
57102-62-2
Product Name
9,9'-Diphenyl-9H,9'H-3,3'-bicarbazole
Structure
Category
Electronic Materials; Organic Light-Emitting Diode (OLED) Materials
Synonyms
BPhCz
IUPAC Name
9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
Molecular Weight
484.60
Molecular Formula
C36H24N2
Canonical SMILES
C1=CC=C(C=C1)N2C3=C(C=C(C=C3)C4=CC5=C(C=C4)N(C6=CC=CC=C65)C7=CC=CC=C7)C8=CC=CC=C82
InChI
InChI=1S/C36H24N2/c1-3-11-27(12-4-1)37-33-17-9-7-15-29(33)31-23-25(19-21-35(31)37)26-20-22-36-32(24-26)30-16-8-10-18-34(30)38(36)28-13-5-2-6-14-28/h1-24H
InChI Key
MHTPESFJWCJELK-UHFFFAOYSA-N
Boiling Point
204.0 - 208.0 °C
Melting Point
721.9 ± 60.0 °C
Purity
95%+
Density
1.19 ± 0.1 g/ml
Appearance
White to Almost white powder to crystal
Storage
Store under inert gas
Complexity
731
Covalently-Bonded Unit Count
1
Exact Mass
484.193949g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
38
MDL Number
MFCD22571688
Monoisotopic Mass
484.193949g/mol
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Rotatable Bond Count
3
Signal Word
Warning
XLogP3
9.7
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