Название: 4-acetoxyferuloyl chloride
SMILES:
COC1C=C(/C=C/C(=O)Cl)C=CC1(O)OC(C)=OMolecular Processing
Molecular formula
C12H13ClO5
Molecular weight
272.68
Exact mass
272.0452
XLogP
1.07
TPSA
72.83
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
18
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
64.74
Supplementary Information
Загрузка подробностей…
Участвует в 1 реакциях→