SMILES:
BrCCCCCOCCc1ccccn1Molecular Processing
Molecular formula
C12H18BrNO
Molecular weight
272.19
Exact mass
271.0572
XLogP
3.21
TPSA
22.12
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
8
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.583
Molar refractivity
66.41
Supplementary Information
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