Home Halogens 1-(3-bromo-5-fluorophenyl)propan-1-amine

1-(3-bromo-5-fluorophenyl)propan-1-amine

CAS No.:
1270372-06-9
Catalog Number:
AG01AFKL
Molecular Formula:
C9H11BrFN
Molecular Weight:
232.0927
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Product Description
Catalog Number:
AG01AFKL
Chemical Name:
1-(3-bromo-5-fluorophenyl)propan-1-amine
CAS Number:
1270372-06-9
Molecular Formula:
C9H11BrFN
Molecular Weight:
232.0927
MDL Number:
MFCD18660093
IUPAC Name:
1-(3-bromo-5-fluorophenyl)propan-1-amine
InChI:
InChI=1S/C9H11BrFN/c1-2-9(12)6-3-7(10)5-8(11)4-6/h3-5,9H,2,12H2,1H3
InChI Key:
WFGZEDKDVSOQAS-UHFFFAOYSA-N
SMILES:
CCC(c1cc(F)cc(c1)Br)N
Properties
Complexity:
143  
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:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties