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3-Iodo-9-phenylcarbazole

Catalog Number
ACM502161037-1
CAS Number
502161-03-7
Product Name
3-Iodo-9-phenylcarbazole
Structure
Category
Small Molecule Semiconductor Building Blocks; Organic Light-Emitting Diode (OLED) Materials; Semiconductor Blocks
IUPAC Name
3-iodo-9-phenylcarbazole
Molecular Weight
369.21
Molecular Formula
C18H12IN
Canonical SMILES
C1=CC=C(C=C1)N2C3=C(C=C(C=C3)I)C4=CC=CC=C42
InChI
InChI=1S/C18H12IN/c19-13-10-11-18-16(12-13)15-8-4-5-9-17(15)20(18)14-6-2-1-3-7-14/h1-12H
InChI Key
PJUAIXDOXUXBDR-UHFFFAOYSA-N
Boiling Point
480.6 ± 27.0 ° C (predicted)
Melting Point
106 °C
Purity
>98.0%(GC)
Density
1.55 ± 0.1 g/mL (predicted)
Appearance
White to Light yellow powder to crystal
Complexity
338
Covalently-Bonded Unit Count
1
Exact Mass
369.00145g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
20
MDL Number
MFCD09261276
Monoisotopic Mass
369.00145g/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
1
Signal Word
Warning
XLogP3
5.6
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