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Home > Bromides > 1308596-49-7
1308596-49-7 | Piperazine, 1-[2-(3-bromophenoxy)ethyl]-4-methyl-
CAS No: 1308596-49-7 Catalog No: AG000V0O MDL No:
Product Description
Catalog Number:
AG000V0O
Chemical Name:
Piperazine, 1-[2-(3-bromophenoxy)ethyl]-4-methyl-
CAS Number:
1308596-49-7
Molecular Formula:
C13H19BrN2O
Molecular Weight:
299.2068
IUPAC Name:
1-[2-(3-bromophenoxy)ethyl]-4-methylpiperazine
InChI:
InChI=1S/C13H19BrN2O/c1-15-5-7-16(8-6-15)9-10-17-13-4-2-3-12(14)11-13/h2-4,11H,5-10H2,1H3
InChI Key:
LPKQAWKVSYWAFC-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)CCOc1cccc(c1)Br
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.068g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.212g/mol
Monoisotopic Mass:
298.068g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
15.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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