이름: (2S)-1-N-[4-(trifluoromethoxy)phenyl]propane-1,2-diamine
SMILES:
CC(CNC1=CC=C(C=C1)OC(F)(F)F)NMolecular Processing
Molecular formula
C10H13F3N2O
Molecular weight
234.22
Exact mass
234.098
XLogP
2.34
TPSA
47.28
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
55.26
Supplementary Information
InChIKey: OCXXYKJHUOYVLB-ZETCQYMHSA-N
동의어
(S)-N-(4-trifluoromethoxy-phenyl)-propane-1,2-diamineSCHEMBL3017459(S)-N 1-(4-Trifluoromethoxy-phenyl)-propane-1,2-diamine(S)-N1-(4-Trifluoromethoxy-phenyl)-propane-1,2-diamineN1-(4-Trifluoromethoxy-phenyl)-(S)-propane-1,2-diamine
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