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885275-22-9 | 1-(2-Bromophenyl)piperazin-2-one
CAS No: 885275-22-9 Catalog No: AG0046CE MDL No:MFCD06658379
Product Description
Catalog Number:
AG0046CE
Chemical Name:
1-(2-Bromophenyl)piperazin-2-one
CAS Number:
885275-22-9
Molecular Formula:
C10H11BrN2O
Molecular Weight:
255.1111
MDL Number:
MFCD06658379
IUPAC Name:
1-(2-bromophenyl)piperazin-2-one
InChI:
InChI=1S/C10H11BrN2O/c11-8-3-1-2-4-9(8)13-6-5-12-7-10(13)14/h1-4,12H,5-7H2
InChI Key:
OHSOSFQRIWWQQV-UHFFFAOYSA-N
SMILES:
O=C1CNCCN1c1ccccc1Br
Properties
Complexity:
222
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:
1
Isotope Atom Count:
0
Molecular Weight:
255.115g/mol
Monoisotopic Mass:
254.005g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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