CC(C)(C1=C(C=CC(=C1)F)OC)C2=C(C=CC(=C2)Cl)O
名称: 4-chloro-2-[2-(5-fluoro-2-methoxyphenyl)propan-2-yl]phenol
SMILES: CC(C)(C1=C(C=CC(=C1)F)OC)C2=C(C=CC(=C2)Cl)O

Molecular Processing

Molecular formula
C16H16ClFO2
Molecular weight
294.75
Exact mass
294.0823
XLogP
4.52
TPSA
29.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
78.2

Supplementary Information

InChIKey: ZZBZDXYBWTVKPH-UHFFFAOYSA-N
同義語
SCHEMBL11305993ZZBZDXYBWTVKPH-UHFFFAOYSA-N2-(5-chloro-2-hydroxyphenyl)-2-(5-fluoro-2-methoxyphenyl)propane
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