Название: 4,5,6-triethoxy-7-nitrophthalide
SMILES:
CCOc1c2c(c([N+](=O)[O-])c(OCC)c1OCC)C(=O)OC2Molecular Processing
Molecular formula
C14H17NO7
Molecular weight
311.29
Exact mass
311.1005
XLogP
2.46
TPSA
97.13
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
22
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
75.72
Supplementary Information
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