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88888-26-0 | Benzenamine, 4-(4-fluorobicyclo[2.2.1]hept-1-yl)-
CAS No: 88888-26-0 Catalog No: AG004935 MDL No:
Product Description
Catalog Number:
AG004935
Chemical Name:
Benzenamine, 4-(4-fluorobicyclo[2.2.1]hept-1-yl)-
CAS Number:
88888-26-0
Molecular Formula:
C13H16FN
Molecular Weight:
205.2712
IUPAC Name:
4-(4-fluoro-1-bicyclo[2.2.1]heptanyl)aniline
InChI:
InChI=1S/C13H16FN/c14-13-7-5-12(9-13,6-8-13)10-1-3-11(15)4-2-10/h1-4H,5-9,15H2
InChI Key:
XZEVIGQRXVSGNP-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)C12CCC(C2)(CC1)F
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.127g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.276g/mol
Monoisotopic Mass:
205.127g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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