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209795-77-7 | Phenol, 4,4'-(1,10-phenanthroline-3,8-diyl)bis-
CAS No: 209795-77-7 Catalog No: AG002KF1 MDL No:
Product Description
Catalog Number:
AG002KF1
Chemical Name:
Phenol, 4,4'-(1,10-phenanthroline-3,8-diyl)bis-
CAS Number:
209795-77-7
Molecular Formula:
C24H16N2O2
Molecular Weight:
364.3960
IUPAC Name:
4-[8-(4-hydroxyphenyl)-1,10-phenanthrolin-3-yl]phenol
InChI:
InChI=1S/C24H16N2O2/c27-21-7-3-15(4-8-21)19-11-17-1-2-18-12-20(16-5-9-22(28)10-6-16)14-26-24(18)23(17)25-13-19/h1-14,27-28H
InChI Key:
UITUSCSGTIFWJU-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)c1cnc2c(c1)ccc1c2ncc(c1)c1ccc(cc1)O
Properties
Complexity:
467
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
364.121g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
364.404g/mol
Monoisotopic Mass:
364.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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