Name: [2,3-Dichloro-4-(2-ethylidenebutyryl)phenoxy]acetic acid
SMILES:
CC=C(CC)C(=O)c1ccc(OCC(=O)O)c(Cl)c1ClMolecular Processing
Molecular formula
C14H14Cl2O4
Molecular weight
317.17
Exact mass
316.0269
XLogP
4
TPSA
63.6
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
77.97
Supplementary Information
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