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910444-36-9 | 2-(2-Bromophenyl)piperazine
CAS No: 910444-36-9 Catalog No: AG01EZ07 MDL No:MFCD07373088
Product Description
Catalog Number:
AG01EZ07
Chemical Name:
2-(2-Bromophenyl)piperazine
CAS Number:
910444-36-9
Molecular Formula:
C10H13BrN2
Molecular Weight:
241.1276
MDL Number:
MFCD07373088
IUPAC Name:
2-(2-bromophenyl)piperazine
InChI:
InChI=1S/C10H13BrN2/c11-9-4-2-1-3-8(9)10-7-12-5-6-13-10/h1-4,10,12-13H,5-7H2
InChI Key:
ZDTWPFQUEVKTCT-UHFFFAOYSA-N
SMILES:
Brc1ccccc1C1CNCCN1
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.026g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
241.132g/mol
Monoisotopic Mass:
240.026g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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