SMILES:
O=CCCOC1COCC1IMolecular Processing
Molecular formula
C7H11IO3
Molecular weight
270.07
Exact mass
269.9753
XLogP
0.79
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
11
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.857
Molar refractivity
49.05
Supplementary Information
Загрузка подробностей…
Участвует в 1 реакциях→