Name: cis-1,2,3,6-Tetrahydrophthalic anhydride
SMILES:
O=C1OC(=O)[C@@H]2CC=CC[C@H]12Molecular Processing
Molecular formula
C8H8O3
Molecular weight
152.15
Exact mass
152.0473
XLogP
0.65
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
0
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
36.45
Supplementary Information
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