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2-Bromo-4,6-diphenylpyrimidine

Catalog Number
ACM56181498
CAS Number
56181-49-8
Product Name
2-Bromo-4,6-diphenylpyrimidine
Structure
Category
Small Molecule Semiconductor Building Blocks; Semiconductor Blocks
IUPAC Name
2-bromo-4,6-diphenylpyrimidine
Molecular Weight
311.18
Molecular Formula
C16H11BrN2
Canonical SMILES
C1=CC=C(C=C1)C2=CC(=NC(=N2)Br)C3=CC=CC=C3
InChI
InChI=1S/C16H11BrN2/c17-16-18-14(12-7-3-1-4-8-12)11-15(19-16)13-9-5-2-6-10-13/h1-11H
InChI Key
GPGIIKKUKINTGW-UHFFFAOYSA-N
Melting Point
129 °C
Purity
>97.0%(GC)
Appearance
White to Light yellow powder to crystal
Complexity
246
Covalently-Bonded Unit Count
1
Exact Mass
310.01056g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
19
MDL Number
MFCD00234884
Monoisotopic Mass
310.01056g/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
2
Signal Word
Warning
XLogP3
4.6
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