[N-]=[N+]=N[C@@H](Cc1ccccc1)[C@H](O)CO
Name: 3(S)-azido-4-phenyl-1,2(S)-butanediol
SMILES: [N-]=[N+]=N[C@@H](Cc1ccccc1)[C@H](O)CO

Molecular Processing

Molecular formula
C10H13N3O2
Molecular weight
207.23
Exact mass
207.1008
XLogP
1.26
TPSA
89.22
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
56.17

Supplementary Information

Details werden geladen…

An 12 Reaktionen beteiligt