Name: 8-hydroxy-2,3-dihydro-benzo[1,4]dioxine-6-carboxylic acid ethyl ester
SMILES:
CCOC(=O)c1cc(O)c2c(c1)OCCO2Molecular Processing
Molecular formula
C11H12O5
Molecular weight
224.21
Exact mass
224.0685
XLogP
1.34
TPSA
64.99
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
55.05
Supplementary Information
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