Nom: (2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
SMILES:
CC(C)C(C(=O)O)NC(=O)OC(C)(C)CMolecular Processing
Molecular formula
C10H19NO4
Molecular weight
217.26
Exact mass
217.1314
XLogP
1.62
TPSA
75.63
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
15
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
55.63
Supplementary Information
InChIKey: SZXBQTSZISFIAO-ZETCQYMHSA-N
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