Fc1cc2c(c(C3CCCN3)c1)OCCO2
Название: 2-(7-fluoro-2,3-dihydro-1,4-benzodioxin-5-yl)pyrrolidine
SMILES: Fc1cc2c(c(C3CCCN3)c1)OCCO2

Molecular Processing

Molecular formula
C12H14FNO2
Molecular weight
223.25
Exact mass
223.1009
XLogP
2.02
TPSA
30.49
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
57.37

Supplementary Information

InChIKey: UXEQOXQYQOWDPN-UHFFFAOYSA-N
Синонимы
SCHEMBL15016772SCHEMBL15016880UXEQOXQYQOWDPN-UHFFFAOYSA-N2-(7-fluoro-2,3-dihydrobenzo[b][1,4]dioxin-5-yl)pyrrolidine2-(7-fluoro-2, 3-dihydrobenzo[b] [1,4]dioxin-5-yl)pyrrolidine
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