名称: ethyl 7-(formylamino)chroman-2-carboxylate
SMILES:
CCOC(=O)C1CCc2ccc(NC=O)cc2O1Molecular Processing
Molecular formula
C13H15NO4
Molecular weight
249.27
Exact mass
249.1001
XLogP
1.51
TPSA
64.63
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
65.5
Supplementary Information
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