名称: (S)-4-(difluoromethoxy)-2-(methoxycarbonylamino) butanoic acid
SMILES:
COC(=O)N[C@@H](CCOC(F)F)C(=O)OMolecular Processing
Molecular formula
C7H11F2NO5
Molecular weight
227.16
Exact mass
227.0605
XLogP
0.42
TPSA
84.86
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
15
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
43.54
Supplementary Information
詳細情報を取得中…
11 件の反応に参加→