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834155-46-3 | Cyclopropanamine, 2-fluoro-1-phenyl-, (1S,2R)-
CAS No: 834155-46-3 Catalog No: AG004RTD MDL No:MFCD17010159
Product Description
Catalog Number:
AG004RTD
Chemical Name:
Cyclopropanamine, 2-fluoro-1-phenyl-, (1S,2R)-
CAS Number:
834155-46-3
Molecular Formula:
C9H10FN
Molecular Weight:
151.1808
MDL Number:
MFCD17010159
IUPAC Name:
(1S,2R)-2-fluoro-1-phenylcyclopropan-1-amine
InChI:
InChI=1S/C9H10FN/c10-8-6-9(8,11)7-4-2-1-3-5-7/h1-5,8H,6,11H2/t8-,9+/m1/s1
InChI Key:
ORKWDOXDSJHZAW-BDAKNGLRSA-N
SMILES:
F[C@@H]1C[C@]1(N)c1ccccc1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
151.08g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.184g/mol
Monoisotopic Mass:
151.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Fluorinated phenylcyclopropylamines. Part 4: effects of aryl substituents and stereochemistry on the inhibition of monoamine oxidases by 1-aryl-2-fluoro-cyclopropylamines. | Bioorganic & medicinal chemistry 20050401 |
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