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113516-71-5 | Cyclopropanamine, 2-(4-fluorophenyl)-, (1R,2S)-rel-
CAS No: 113516-71-5 Catalog No: AG0008UZ MDL No:
Product Description
Catalog Number:
AG0008UZ
Chemical Name:
Cyclopropanamine, 2-(4-fluorophenyl)-, (1R,2S)-rel-
CAS Number:
113516-71-5
Molecular Formula:
C9H10FN
Molecular Weight:
151.1808
IUPAC Name:
(1R,2S)-2-(4-fluorophenyl)cyclopropan-1-amine
InChI:
InChI=1S/C9H10FN/c10-7-3-1-6(2-4-7)8-5-9(8)11/h1-4,8-9H,5,11H2/t8-,9+/m0/s1
InChI Key:
GTYFDGYGRFJTKJ-DTWKUNHWSA-N
SMILES:
N[C@@H]1C[C@H]1c1ccc(cc1)F
Properties
Complexity:
141
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:
1.6
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