Name: Tert-butyl bicyclo[3.2.0]hept-3-en-6-ylideneacetate
SMILES:
CC(C)(C)OC(=O)C=C1CC2CC=CC12Molecular Processing
Molecular formula
C13H18O2
Molecular weight
206.28
Exact mass
206.1307
XLogP
2.85
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
0
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
59.28
Supplementary Information
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