الاسم: nitropropyne
SMILES:
C#CCn1ccnc1[N+](=O)[O-]Molecular Processing
Molecular formula
C6H5N3O2
Molecular weight
151.12
Exact mass
151.0382
XLogP
0.42
TPSA
60.96
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
37.71
Supplementary Information
No supplementary data available
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