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1,10-Phenanthrolin-5-amine

Catalog Number
ACM54258412-2
CAS Number
54258-41-2
Product Name
1,10-Phenanthrolin-5-amine
Structure
Category
Organic Light-Emitting Diode (OLED) Materials
Synonyms
5-Amino-1,10-phenanthroline
IUPAC Name
1,10-phenanthrolin-5-amine
Molecular Weight
195.22
Molecular Formula
C12H9N3
Canonical SMILES
C1=CC2=CC(=C3C=CC=NC3=C2N=C1)N
InChI
DKPSSMOJHLISJI-UHFFFAOYSA-N
InChI Key
InChI=1S/C12H9N3/c13-10-7-8-3-1-5-14-11(8)12-9(10)4-2-6-15-12/h1-7H,13H2
Boiling Point
441.1 °C at 760 mmHg
Melting Point
254-258 °C -lit.
Purity
98%
Appearance
Brown to orange solid
Complexity
231
Covalently-Bonded Unit Count
1
Exact Mass
195.079647300
Formal Charge
0
Heavy Atom Count
15
Hydrogen Bond Acceptor Count
3
Hydrogen Bond Donor Count
1
Monoisotopic Mass
195.079647300
Rotatable Bond Count
0
Topological Polar Surface Area
51.8 Ų
XLogP3
1.8
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