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1019568-30-9 | Benzenemethanamine, 5-bromo-N-cyclohexyl-2-fluoro-
CAS No: 1019568-30-9 Catalog No: AG000629 MDL No:MFCD11138548
Product Description
Catalog Number:
AG000629
Chemical Name:
Benzenemethanamine, 5-bromo-N-cyclohexyl-2-fluoro-
CAS Number:
1019568-30-9
Molecular Formula:
C13H17BrFN
Molecular Weight:
286.1832
MDL Number:
MFCD11138548
IUPAC Name:
N-[(5-bromo-2-fluorophenyl)methyl]cyclohexanamine
InChI:
InChI=1S/C13H17BrFN/c14-11-6-7-13(15)10(8-11)9-16-12-4-2-1-3-5-12/h6-8,12,16H,1-5,9H2
InChI Key:
MMKZQIJUUVSQAS-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1CNC1CCCCC1)Br
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.053g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.188g/mol
Monoisotopic Mass:
285.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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