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B4PyMPM

Catalog Number
ACM1030380518
Product Name
B4PyMPM
Structure
CAS
1030380-51-8
Category
Organic Light-Emitting Diode (OLED) Materials
IUPAC Name
4,6-bis(3,5-dipyridin-4-ylphenyl)-2-methylpyrimidine
Molecular Weight
554.6g/mol
Molecular Formula
C37H26N6
Canonical SMILES
CC1=NC(=CC(=N1)C2=CC(=CC(=C2)C3=CC=NC=C3)C4=CC=NC=C4)C5=CC(=CC(=C5)C6=CC=NC=C6)C7=CC=NC=C7
InChI
InChI=1S/C37H26N6/c1-25-42-36(34-20-30(26-2-10-38-11-3-26)18-31(21-34)27-4-12-39-13-5-27)24-37(43-25)35-22-32(28-6-14-40-15-7-28)19-33(23-35)29-8-16-41-17-9-29/h2-24H,1H3
InChI Key
WCXNEXQHQNXXEA-UHFFFAOYSA-N
Complexity
711
Covalently-Bonded Unit Count
1
Exact Mass
554.221895g/mol
Formal Charge
0
Heavy Atom Count
43
Monoisotopic Mass
554.221895g/mol
Rotatable Bond Count
6
XLogP3
6.2
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