Home Halogens 3-(4-bromophenyl)piperazin-2-one

3-(4-bromophenyl)piperazin-2-one

CAS No.:
90841-19-3
Catalog Number:
AG01BHCI
Molecular Formula:
C10H11BrN2O
Molecular Weight:
255.1111
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Product Description
Catalog Number:
AG01BHCI
Chemical Name:
3-(4-bromophenyl)piperazin-2-one
CAS Number:
90841-19-3
Molecular Formula:
C10H11BrN2O
Molecular Weight:
255.1111
MDL Number:
MFCD07373594
IUPAC Name:
3-(4-bromophenyl)piperazin-2-one
InChI:
InChI=1S/C10H11BrN2O/c11-8-3-1-7(2-4-8)9-10(14)13-6-5-12-9/h1-4,9,12H,5-6H2,(H,13,14)
InChI Key:
CQRGSJDXPCSHAJ-UHFFFAOYSA-N
SMILES:
O=C1NCCNC1c1ccc(cc1)Br
Properties
Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.005g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
255.115g/mol
Monoisotopic Mass:
254.005g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties