이름: 7-(4-chlorophenoxy)-5-hydroxy-5,6,6-trimethyl-hept-1-ene
SMILES:
C=CCCC(C)(O)C(C)(C)COc1ccc(Cl)cc1Molecular Processing
Molecular formula
C16H23ClO2
Molecular weight
282.81
Exact mass
282.1387
XLogP
4.46
TPSA
29.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
7
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
80.78
Supplementary Information
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