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163521-16-2 | Piperazine, 1-(2,3-dihydro-5-benzofuranyl)-
CAS No: 163521-16-2 Catalog No: AG001U70 MDL No:
Product Description
Catalog Number:
AG001U70
Chemical Name:
Piperazine, 1-(2,3-dihydro-5-benzofuranyl)-
CAS Number:
163521-16-2
Molecular Formula:
C12H16N2O
Molecular Weight:
204.2682
IUPAC Name:
1-(2,3-dihydro-1-benzofuran-5-yl)piperazine
InChI:
InChI=1S/C12H16N2O/c1-2-12-10(3-8-15-12)9-11(1)14-6-4-13-5-7-14/h1-2,9,13H,3-8H2
InChI Key:
DVVCESKEEKGQDK-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)c1ccc2c(c1)CCO2
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.126g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.273g/mol
Monoisotopic Mass:
204.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
24.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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