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Structure

4,7-Phenanthroline

CAS
230-07-9
Catalog Number
ACM230079
Category
Other Products
Molecular Weight
180.21g/mol
Molecular Formula
C12H8N2;

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Specification

Synonyms
NCGC00246932-01; AKOS000267409; AC-907/25014296; DATYUTWESAKQQM-UHFFFAOYSA-N; CHEBI:36419; MLS000738107; SCHEMBL217044; AK306165; DTXSID30177552; F3099-7191;
IUPAC Name
4,7-phenanthroline;
Canonical SMILES
C1=CC2=C(C=CC3=C2C=CC=N3)N=C1;
InChI
InChI=1S/C12H8N2/c1-3-9-10-4-2-8-14-12(10)6-5-11(9)13-7-1/h1-8H;
InChI Key
DATYUTWESAKQQM-UHFFFAOYSA-N;
Melting Point
177.0°C;
Complexity
183
Covalently-Bonded Unit Count
1
Exact Mass
180.069g/mol
H-Bond Acceptor
2
Heavy Atom Count
14
Monoisotopic Mass
180.069g/mol
NSC Number
35680
Octanol Water Partition Coefficient
2.05 (LogP);
Topological Polar Surface Area
25.8A^2
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