名称: 4-benzyloxy-3,3-dimethylbut-1-yne
SMILES:
C#CC(C)(C)COCc1ccccc1Molecular Processing
Molecular formula
C13H16O
Molecular weight
188.27
Exact mass
188.1201
XLogP
2.86
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
58.71
Supplementary Information
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