이름: methyl 3-(2-methylpropylidene)-4-oxochroman-7-carboxylate
SMILES:
COC(=O)c1ccc2c(c1)OCC(=CC(C)C)C2=OMolecular Processing
Molecular formula
C15H16O4
Molecular weight
260.29
Exact mass
260.1049
XLogP
2.63
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
70.53
Supplementary Information
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