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1216635-19-6 | N-[2-(4-Bromo-2-fluorophenyl)ethyl]-N-methylamine
CAS No: 1216635-19-6 Catalog No: AG01F974 MDL No:
Product Description
Catalog Number:
AG01F974
Chemical Name:
N-[2-(4-Bromo-2-fluorophenyl)ethyl]-N-methylamine
CAS Number:
1216635-19-6
Molecular Formula:
C9H11BrFN
Molecular Weight:
232.0927
IUPAC Name:
2-(4-bromo-2-fluorophenyl)-N-methylethanamine
InChI:
InChI=1S/C9H11BrFN/c1-12-5-4-7-2-3-8(10)6-9(7)11/h2-3,6,12H,4-5H2,1H3
InChI Key:
OIIJNPOYTODHBY-UHFFFAOYSA-N
SMILES:
CNCCc1ccc(cc1F)Br
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.006g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.096g/mol
Monoisotopic Mass:
231.006g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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