CAS: 111336-25-5
名称: 2-(4-methoxyphenyl)-5-octylpyridine
SMILES:
CCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OCMolecular Processing
Molecular formula
C20H27NO
Molecular weight
297.44
Exact mass
297.2093
XLogP
5.66
TPSA
22.12
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
9
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.45
Molar refractivity
93.31
Supplementary Information
InChIKey: HEFJYQPXMXQXSJ-UHFFFAOYSA-N
同義語
111336-25-52-(4-METHOXYPHENYL)-5-OCTYLPYRIDINESCHEMBL9226435DTXSID30555412HEFJYQPXMXQXSJ-UHFFFAOYSA-N2-(p-methoxyphenyl)-5-octylpyridine2-(4-Methoxy-phenyl)-5-octyl-pyridine5-Octyl-2-(4'-methoxyphenyl)-pyridine
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