Synonyms
1,10-Phenanthroline,4,7-Dichloro
IUPAC Name
4,7-dichloro-1,10-phenanthroline
Molecular Weight
249.10
Molecular Formula
C12H6Cl2N2
Canonical SMILES
C1=CC2=C(C=CN=C2C3=NC=CC(=C31)Cl)Cl;
InChI
GIEQBYJCGYHHSU-UHFFFAOYSA-N
InChI Key
InChI=1S/C12H6Cl2N2/c13-9-3-5-15-11-7(9)1-2-8-10(14)4-6-16-12(8)11/h1-6H
Boiling Point
395.9 °C at 760 mmHg
Melting Point
243-247 °C
Purity
97%
Appearance
Solid
Complexity
235
Covalently-Bonded Unit Count
1
Exact Mass
247.991g/mol
H-Bond Acceptor
2
Heavy Atom Count
16
Isomeric SMILES
C1=CC2=C(C=CN=C2C3=NC=CC(=C31)Cl)Cl
Monoisotopic Mass
247.991g/mol
NSC Number
626
Topological Polar Surface Area
25.8A^2
