Name: 2,7-bis(4-chlorobutyryl)-xanthene
SMILES:
O=C(CCCCl)c1ccc2c(c1)Cc1cc(C(=O)CCCCl)ccc1O2Molecular Processing
Molecular formula
C21H20Cl2O3
Molecular weight
391.29
Exact mass
390.0789
XLogP
5.79
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
104.33
Supplementary Information
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