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100500-10-5 | 4,7-Phenanthroline, 3,8-dichloro-
CAS No: 100500-10-5 Catalog No: AG00026C MDL No:
Product Description
Catalog Number:
AG00026C
Chemical Name:
4,7-Phenanthroline, 3,8-dichloro-
CAS Number:
100500-10-5
Molecular Formula:
C12H6Cl2N2
Molecular Weight:
249.0954
IUPAC Name:
3,8-dichloro-4,7-phenanthroline
InChI:
InChI=1S/C12H6Cl2N2/c13-11-5-1-7-8-2-6-12(14)16-10(8)4-3-9(7)15-11/h1-6H
InChI Key:
RHYOPHSCZQOANB-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(n1)ccc1c2ccc(n1)Cl
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.991g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.094g/mol
Monoisotopic Mass:
247.991g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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