ethyl 4-[2-[5,5-dimethyl-8-(4-methylphenyl)-6H-naphthalen-2-yl]ethynyl]benzoate


Chemical Name: ethyl 4-[2-[5,5-dimethyl-8-(4-methylphenyl)-6H-naphthalen-2-yl]ethynyl]benzoate
CAS Number: 171568-43-7
Product Number: AG0077OZ(AGN-PC-00GCC8)
Synonyms:
MDL No: MFCD18382149
Molecular Formula: C30H28O2
Molecular Weight: 420.5421

Identification/Properties


Computed Properties
Molecular Weight:
420.552g/mol
XLogP3:
7.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
6
Exact Mass:
420.209g/mol
Monoisotopic Mass:
420.209g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
32
Formal Charge:
0
Complexity:
746
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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