Name: ethyl 2-(2-phenylethyl)acetoacetate
SMILES:
CCOC(=O)C(CCc1ccccc1)C(C)=OMolecular Processing
Molecular formula
C14H18O3
Molecular weight
234.3
Exact mass
234.1256
XLogP
2.39
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
65.57
Supplementary Information
Details werden geladen…
An 22 Reaktionen beteiligt→