Name: 5-[(2E)-3-(dimethylamino)prop-2-enoyl]-2-methoxybenzyl pivalate
SMILES:
COc1ccc(C(=O)/C=C/N(C)C)cc1COC(=O)C(C)(C)CMolecular Processing
Molecular formula
C18H25NO4
Molecular weight
319.4
Exact mass
319.1784
XLogP
3.04
TPSA
55.84
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
89.4
Supplementary Information
Details werden geladen…
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