名称: {2-[2-(6-Chloro-hexyloxy)-ethoxy]-ethyl}-carbamic acid anthracen-9-ylmethyl ester
SMILES:
O=C(NCCOCCOCCCCCCCl)OCc1c2ccccc2cc2ccccc12Molecular Processing
Molecular formula
C26H32ClNO4
Molecular weight
458
Exact mass
457.202
XLogP
6.05
TPSA
56.79
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
14
Heavy atoms
32
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.423
Molar refractivity
130.47
Supplementary Information
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