O=C1OC(=O)[C@H]2[C@@H]1[C@@H]1C=C[C@H]2C1
Name: cis-5-Norbornene-exo-2,3-dicarboxylic anhydride
SMILES: O=C1OC(=O)[C@H]2[C@@H]1[C@@H]1C=C[C@H]2C1

Molecular Processing

Molecular formula
C9H8O3
Molecular weight
164.16
Exact mass
164.0473
XLogP
0.51
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
12
Rings
3
Aromatic rings
0
Saturated rings
2
Aliphatic rings
3
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
38.82

Supplementary Information

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