CC(C)N1C(=O)c2ccc(Br)cc2C1=O
Name: 5-bromo-2-(1-methylethyl)-1H-isoindole-1,3(2H)-dione
SMILES: CC(C)N1C(=O)c2ccc(Br)cc2C1=O

Molecular Processing

Molecular formula
C11H10BrNO2
Molecular weight
268.11
Exact mass
266.9895
XLogP
2.45
TPSA
37.38
H-bond donors
0
H-bond acceptors
2
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
4
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
59.78

Supplementary Information

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