CC(CO)NC1=C(C(=C(C=C1)F)F)F
Nom: (2S)-2-(2,3,4-trifluoroanilino)propan-1-ol
SMILES: CC(CO)NC1=C(C(=C(C=C1)F)F)F

Molecular Processing

Molecular formula
C9H10F3NO
Molecular weight
205.18
Exact mass
205.0714
XLogP
1.9
TPSA
32.26
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
46.49

Supplementary Information

InChIKey: FUBMYBDUIXQPOU-YFKPBYRVSA-N
Synonymes
SCHEMBL2330887FUBMYBDUIXQPOU-YFKPBYRVSA-N(2S)-2-(2,3,4-Trifluoroanilino)propanol(2S)-2-(2,3,4-Trifluoroanilino)-1-propanol
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Impliqué dans 71 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→