Home Halogens 1-(5-bromofuran-2-carbonyl)piperazine

1-(5-bromofuran-2-carbonyl)piperazine

CAS No.:
66204-30-6
Catalog Number:
AG019NA8
Molecular Formula:
C9H11BrN2O2
Molecular Weight:
259.0998
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Product Description
Catalog Number:
AG019NA8
Chemical Name:
1-(5-bromofuran-2-carbonyl)piperazine
CAS Number:
66204-30-6
Molecular Formula:
C9H11BrN2O2
Molecular Weight:
259.0998
MDL Number:
MFCD08444697
IUPAC Name:
(5-bromofuran-2-yl)-piperazin-1-ylmethanone
InChI:
InChI=1S/C9H11BrN2O2/c10-8-2-1-7(14-8)9(13)12-5-3-11-4-6-12/h1-2,11H,3-6H2
InChI Key:
UADOQGQGJDYASH-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(o1)Br)N1CCNCC1
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
259.103g/mol
Monoisotopic Mass:
258g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties