1,10-PHENANTHROLINE, 4,7-DIMETHYL-

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII P3YJ54Z8ZO
EPA CompTox DTXSID9062932

Structure

InChI Key JIVLDFFWTQYGSR-UHFFFAOYSA-N
Smiles Cc1ccnc2c3nccc(C)c3ccc12
InChI
InChI=1S/C14H12N2/c1-9-5-7-15-13-11(9)3-4-12-10(2)6-8-16-14(12)13/h3-8H,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H12N2
Molecular Weight 208.1
AlogP 3.4
Hydrogen Bond Acceptor 2.0
Polar Surface Area 25.78
Heavy Atoms 16.0

Cross References

Resources Reference
CAS NUMBER 3248-05-3
NORMAN SUSDAT
FDA SRS P3YJ54Z8ZO
PubChem 72792
ChemSpider 65628.0
CONTENTS