CC1=CC=C(C=C1)C2=C(C=C(C=C2N)N)N
Nombre: 2-(4-methylphenyl)benzene-1,3,5-triamine
SMILES: CC1=CC=C(C=C1)C2=C(C=C(C=C2N)N)N

Molecular Processing

Molecular formula
C13H15N3
Molecular weight
213.28
Exact mass
213.1266
XLogP
2.41
TPSA
78.06
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
69.85

Supplementary Information

InChIKey: GTNZVEGWHJSEKV-UHFFFAOYSA-N
Sinónimos
SCHEMBL2336893GTNZVEGWHJSEKV-UHFFFAOYSA-N2',4',6'-triamino-4-methylbiphenyl
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