Название: 4-ethynyl-2-isopropyl-1-(1-methyl-cyclopropoxymethyl)-benzene
SMILES:
C#Cc1ccc(COC2(C)CC2)c(C(C)C)c1Molecular Processing
Molecular formula
C16H20O
Molecular weight
228.33
Exact mass
228.1514
XLogP
3.86
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
70.89
Supplementary Information
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