C1=C(C(=CC2=C1OC(C(O2)(F)F)(F)F)F)N
CAS: 120934-05-6
이름: 2,2,3,3,6-pentafluoro-1,4-benzodioxin-7-amine
SMILES: C1=C(C(=CC2=C1OC(C(O2)(F)F)(F)F)F)N

Molecular Processing

Molecular formula
C8H4F5NO2
Molecular weight
241.11
Exact mass
241.0162
XLogP
2.36
TPSA
44.48
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
41.96

Supplementary Information

InChIKey: UELRRGSPDPPNDO-UHFFFAOYSA-N
동의어
120934-05-62,2,3,3,7-pentafluoro-2,3-dihydro-1,4-benzodioxin-6-amine6-Amino-2,2,3,3,7-pentafluoro-1,4-benzodioxane6-Amino-2,2,3,3,7-pentafluoro-1,4-benzodioxene2,2,3,3,6-pentafluoro-1,4-benzodioxin-7-amine2,2,3,3,7-pentafluoro-2,3-dihydrobenzo[b][1,4]dioxin-6-amine2,3-Dihydro-2,2,3,3,7-pentafluoro-1,4-benzodioxin-6-amine, 2,2,3,3,7-Pentafluoro-1,4-benzodioxan-6-amineSCHEMBL519393MFCD08275275SBB099388AKOS025393502PS-75742,2,3,3,7-pentafluorobenzo[e]1,4-dioxane-6-ylamine
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