الاسم: 3-phenyl-4-hydroxy-5,6,7,8-tetrahydro-coumarin
SMILES:
O=c1oc2c(c(O)c1-c1ccccc1)CCCC2Molecular Processing
Molecular formula
C15H14O3
Molecular weight
242.27
Exact mass
242.0943
XLogP
2.89
TPSA
50.44
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
68.72
Supplementary Information
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