الاسم: ethyl 4-bromo-3-methoxy-2-pentenoate
SMILES:
CCOC(=O)C=C(OC)C(C)BrMolecular Processing
Molecular formula
C8H13BrO3
Molecular weight
237.09
Exact mass
236.0048
XLogP
1.86
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
12
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
50.11
Supplementary Information
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