이름: (6-amino-7-methoxy-2,3-dihydro-1H-inden-1-ylidene)acetonitrile
SMILES:
COc1c(N)ccc2c1C(=CC#N)CC2Molecular Processing
Molecular formula
C12H12N2O
Molecular weight
200.24
Exact mass
200.095
XLogP
2.13
TPSA
59.04
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
59.32
Supplementary Information
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