名称: methyl 5-amino-2-fluorobenzoate
SMILES:
COC(=O)c1cc(N)ccc1FMolecular Processing
Molecular formula
C8H8FNO2
Molecular weight
169.16
Exact mass
169.0539
XLogP
1.19
TPSA
52.32
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
42.15
Supplementary Information
詳細情報を取得中…
49 件の反応に参加→