이름: methyl 2-bromocyclooctene-3-glycolate
SMILES:
COC(=O)C(O)C1CCCCCC=C1BrMolecular Processing
Molecular formula
C11H17BrO3
Molecular weight
277.16
Exact mass
276.0361
XLogP
2.38
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.727
Molar refractivity
61.61
Supplementary Information
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