SMILES:
CC(CCCBr)(COC1CCCCO1)c1ccccc1Molecular Processing
Molecular formula
C17H25BrO2
Molecular weight
341.29
Exact mass
340.1038
XLogP
4.66
TPSA
18.46
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
7
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.647
Molar refractivity
86.37
Supplementary Information
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Involved in 8 reactions→