이름: 2-(4-Nitrobenzyl)-5-propyl-1,3,4-oxadiazole
SMILES:
CCCc1nnc(Cc2ccc([N+](=O)[O-])cc2)o1Molecular Processing
Molecular formula
C12H13N3O3
Molecular weight
247.25
Exact mass
247.0957
XLogP
2.52
TPSA
82.06
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
64.2
Supplementary Information
상세 정보 불러오는 중…
2개 반응에 참여→