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1263281-45-3 | Cyclopentanamine, 2-(4-iodophenyl)-, (1R,2R)-rel-
CAS No: 1263281-45-3 Catalog No: AG000SM3 MDL No:MFCD22520212
Product Description
Catalog Number:
AG000SM3
Chemical Name:
Cyclopentanamine, 2-(4-iodophenyl)-, (1R,2R)-rel-
CAS Number:
1263281-45-3
Molecular Formula:
C11H14IN
Molecular Weight:
287.1400
MDL Number:
MFCD22520212
IUPAC Name:
(1S,2S)-2-(4-iodophenyl)cyclopentan-1-amine
InChI:
InChI=1S/C11H14IN/c12-9-6-4-8(5-7-9)10-2-1-3-11(10)13/h4-7,10-11H,1-3,13H2/t10-,11-/m0/s1
InChI Key:
NIXWOCOUOFZCCE-QWRGUYRKSA-N
SMILES:
N[C@@H]1CCC[C@@H]1c1ccc(cc1)I
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
287.017g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.144g/mol
Monoisotopic Mass:
287.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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