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3-(3-fluorophenoxy)propan-1-amine

3-(3-fluorophenoxy)propan-1-amine

CAS: 116753-49-2

Formula: C9H12FNO

SMILES: NCCCOC1=CC=CC(F)=C1

IUPAC: 3-(3-fluorophenoxy)propan-1-amine

InChI: InChI=1S/C9H12FNO/c10-8-3-1-4-9(7-8)12-6-2-5-11/h1,3-4,7H,2,5-6,11H2

Composition: C (63.89%), H (7.15%), F (11.23%), N (8.28%), O (9.46%)

Molar Mass: 169.199

Atom Count: 24

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 169.090292173
Formal Charge 0
FSP3 0.33
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey SGTGOMOPUIFZSE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.55
Topological Polar Surface Area 35.25
Polarizability 17.71
Ring Count 1
Rotatable Bond Count 4

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