C1=CC(=CC(=C1)N=C(N)N)C(F)(F)F.[N+](=O)(O)[O-]
CAS: 71198-38-4
Nom: nitric acid;2-[3-(trifluoromethyl)phenyl]guanidine
SMILES: C1=CC(=CC(=C1)N=C(N)N)C(F)(F)F.[N+](=O)(O)[O-]

Molecular Processing

Molecular formula
C8H9F3N4O3
Molecular weight
266.18
Exact mass
266.0627
XLogP
1.26
TPSA
127.77
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
2
Fraction Csp3
0.125
Molar refractivity
55.69

Supplementary Information

InChIKey: VVIBNGXNJXFWCG-UHFFFAOYSA-N
Synonymes
3-trifluoromethyl-phenylguanidine nitrate71198-38-4SCHEMBL4479271SCHEMBL5733225DTXSID30500200NSC289092NSC-2890923-trifluoromethylphenyl-guanidine nitrate3-trifluoromethyl-phenyl-guanidine nitrateNitric acid--N''-[3-(trifluoromethyl)phenyl]guanidine (1/1)
Voir la source →
Impliqué dans 3 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→