Name: ethyl 10-(3-iodophenoxy)undecanoate
SMILES:
CCOC(=O)CCCCCCCCC(C)Oc1cccc(I)c1Molecular Processing
Molecular formula
C19H29IO3
Molecular weight
432.34
Exact mass
432.1161
XLogP
5.74
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
12
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.632
Molar refractivity
102.82
Supplementary Information
Details werden geladen…
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