CC1=NC(=NO1)C2=CC=C(C=C2)N
CAS: 10185-68-9
Name: 4-(5-methyl-1,2,4-oxadiazol-3-yl)aniline
SMILES: CC1=NC(=NO1)C2=CC=C(C=C2)N

Molecular Processing

Molecular formula
C9H9N3O
Molecular weight
175.19
Exact mass
175.0746
XLogP
1.63
TPSA
64.94
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
48.88

Supplementary Information

InChIKey: GXOWTIUKDYSZKJ-UHFFFAOYSA-N
Synonyme
4-(5-Methyl-1,2,4-oxadiazol-3-yl)aniline10185-68-9DTXSID70592700RefChem:288328DTXCID20543464844-369-3Benzenamine, 4-(5-methyl-1,2,4-oxadiazol-3-yl)-MFCD08435856SCHEMBL1353609GXOWTIUKDYSZKJ-UHFFFAOYSA-NKAA18568SBB089041AKOS007930409PS-6246CS-02049974-(5-methyl-1,2,4-oxadiazol-3-yl)-anilineEN300-1526374-(5-methyl-1,2,4-oxadiazol-3-yl)phenylamine4-(5-Methyl[1,2,4]oxadiazol-3-yl)phenylamine4-(5-methyl-[1,2,4]oxadiazol-3-yl)phenylamine4-(5-methyl-1,2,4-oxadiazol-3-yl)benzeneamine4-(5-Methyl-[1,2,4]oxadiazol-3-yl)-phenylamineZ427942110
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