Name: product
SMILES:
C=C(OCC)C1=C2c3ccc(OC)c(Cl)c3CC2(CCCC)CCC1=OMolecular Processing
Molecular formula
C22H27ClO3
Molecular weight
374.91
Exact mass
374.1649
XLogP
5.75
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
26
Rings
3
Aromatic rings
1
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
105.59
Supplementary Information
Details werden geladen…
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