Name: 5,7-diethoxy-3-(2-hydroxyethyl)-4-methyl-2H-1-benzopyran-2-one
SMILES:
CCOc1cc(OCC)c2c(C)c(CCO)c(=O)oc2c1Molecular Processing
Molecular formula
C16H20O5
Molecular weight
292.33
Exact mass
292.1311
XLogP
2.43
TPSA
68.9
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
80.35
Supplementary Information
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