COC1O[C@H](C(C)OC(=O)c2ccccc2)C[C@H]1N=[N+]=[N-]
名称: 1-[(2S,4R)-4-azido-5-methoxy-tetrahydrofuran-2-yl]ethyl benzoate
SMILES: COC1O[C@H](C(C)OC(=O)c2ccccc2)C[C@H]1N=[N+]=[N-]

Molecular Processing

Molecular formula
C14H17N3O4
Molecular weight
291.31
Exact mass
291.1219
XLogP
2.67
TPSA
93.52
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
4
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
74.54

Supplementary Information

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