이름: methyl 3-(cyclopentylmethylene)-4-oxochroman-7-carboxylate
SMILES:
COC(=O)c1ccc2c(c1)OCC(=CC1CCCC1)C2=OMolecular Processing
Molecular formula
C17H18O4
Molecular weight
286.33
Exact mass
286.1205
XLogP
3.16
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
77.65
Supplementary Information
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