Name: [3-(3-hydroxyprop-1-ynyl)phenoxy]acetic acid tert-butyl ester
SMILES:
CC(C)(C)OC(=O)COc1cccc(C#CCO)c1Molecular Processing
Molecular formula
C15H18O4
Molecular weight
262.3
Exact mass
262.1205
XLogP
1.75
TPSA
55.76
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
71.75
Supplementary Information
Details werden geladen…
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