名称: methyl-3-(methoxycarbonyl)amino-4-methoxy-isoxazole-5-carboxylate
SMILES:
COC(=O)Nc1noc(C(=O)OC)c1OCMolecular Processing
Molecular formula
C8H10N2O6
Molecular weight
230.18
Exact mass
230.0539
XLogP
0.65
TPSA
99.89
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
50.42
Supplementary Information
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