CC1(C)CCCCc2ccc(Br)cc21
SMILES: CC1(C)CCCCc2ccc(Br)cc21

Molecular Processing

Molecular formula
C13H17Br
Molecular weight
253.18
Exact mass
252.0514
XLogP
4.45
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
0
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
64.72

Supplementary Information

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