3-(3-Fluorophenoxy)propylamine - CAS 116753-49-2
Catalog: |
BB003811 |
Product Name: |
3-(3-Fluorophenoxy)propylamine |
CAS: |
116753-49-2 |
Synonyms: |
3-(3-fluorophenoxy)-1-propanamine; 3-(3-fluorophenoxy)propan-1-amine |
IUPAC Name: | 3-(3-fluorophenoxy)propan-1-amine |
Description: | 3-(3-Fluorophenoxy)propylamine (CAS# 116753-49-2) is a useful research chemical. |
Molecular Weight: | 169.20 |
Molecular Formula: | C9H12FNO |
Canonical SMILES: | C1=CC(=CC(=C1)F)OCCCN |
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 |
InChI Key: | SGTGOMOPUIFZSE-UHFFFAOYSA-N |
Boiling Point: | 245.2 °C at 760 mmHg |
Density: | 1.096 g/cm3 |
LogP: | 2.25360 |
Publication Number | Title | Priority Date |
EP-2828238-A1 | Sulphonamide derivatives of benzylamine for the treatment of cns diseases | 20120320 |
EP-2828238-B1 | Sulphonamide derivatives of benzylamine for the treatment of cns diseases | 20120320 |
US-2015051257-A1 | Sulphonamide derivatives of benzylamine for the treatment of cns diseases | 20120320 |
WO-2013140347-A1 | Sulphonamide derivatives of benzylamine for the treatment of cns diseases | 20120320 |
EP-1280781-A1 | 5-ht 7 receptor antagonists | 20000509 |
Complexity: | 121 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 169.090292168 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 169.090292168 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 35.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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