Nombre: (3-methoxy-4-methoxycarbonylphenyl) 3,4-dihydro-2H-chromene-4-carboxylate
SMILES:
COC(=O)c1ccc(OC(=O)C2CCOc3ccccc32)cc1OCMolecular Processing
Molecular formula
C19H18O6
Molecular weight
342.35
Exact mass
342.1103
XLogP
2.95
TPSA
71.06
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
89.26
Supplementary Information
InChIKey: KENCMAVZCUBPQD-UHFFFAOYSA-N
Sinónimos
SCHEMBL7355809KENCMAVZCUBPQD-UHFFFAOYSA-Nmethyl 4-(4-chromanoyloxy)-2-methoxybenzoate
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