名称: 2-chloro-5-isopropyl-phenol
SMILES:
CC(C)c1ccc(Cl)c(O)c1Molecular Processing
Molecular formula
C9H11ClO
Molecular weight
170.64
Exact mass
170.0498
XLogP
3.17
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
47.21
Supplementary Information
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