SMILES:
CCOC(=N)c1ccc(OCCCCCBr)cc1Molecular Processing
Molecular formula
C14H20BrNO2
Molecular weight
314.22
Exact mass
313.0677
XLogP
3.99
TPSA
42.31
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
78.04
Supplementary Information
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