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114491-63-3 | Methanone, 1,1'-[(1,2-ethanediyl)diphenylene]bis[1-phenyl-, 1,1'-dihydrazone
CAS No: 114491-63-3 Catalog No: AG000EJD MDL No:
Product Description
Catalog Number:
AG000EJD
Chemical Name:
Methanone, 1,1'-[(1,2-ethanediyl)diphenylene]bis[1-phenyl-, 1,1'-dihydrazone
CAS Number:
114491-63-3
Molecular Formula:
C28H26N4
Molecular Weight:
418.5328
IUPAC Name:
[phenyl-[2-[2-[2-(C-phenylcarbonohydrazonoyl)phenyl]ethyl]phenyl]methylidene]hydrazine
InChI:
InChI=1S/C28H26N4/c29-31-27(23-13-3-1-4-14-23)25-17-9-7-11-21(25)19-20-22-12-8-10-18-26(22)28(32-30)24-15-5-2-6-16-24/h1-18H,19-20,29-30H2
InChI Key:
QATMNBFIVUZLLH-UHFFFAOYSA-N
SMILES:
NN=C(c1ccccc1CCc1ccccc1C(=NN)c1ccccc1)c1ccccc1
Properties
Complexity:
561
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
418.216g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
418.544g/mol
Monoisotopic Mass:
418.216g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
76.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
6.7
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