이름: methyl 1-acetylamino-2-chloro6,7,8,9-tetrahydrodibenzofuran-4-carboxylate
SMILES:
COC(=O)c1cc(Cl)c(NC(C)=O)c2c3c(oc12)CCCC3Molecular Processing
Molecular formula
C16H16ClNO4
Molecular weight
321.76
Exact mass
321.0768
XLogP
3.71
TPSA
68.54
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
83.51
Supplementary Information
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