이름: 5-bromo-2-isopropyl-4-methoxy-phenol
SMILES:
COc1cc(C(C)C)c(O)cc1BrMolecular Processing
Molecular formula
C10H13BrO2
Molecular weight
245.12
Exact mass
244.0099
XLogP
3.29
TPSA
29.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
13
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
0.4
Molar refractivity
56.45
Supplementary Information
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