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1254115-23-5 | Piperazine, 1-(3-oxetanyl)-
CAS No: 1254115-23-5 Catalog No: AG000NNI MDL No:MFCD21847918
Product Description
Catalog Number:
AG000NNI
Chemical Name:
Piperazine, 1-(3-oxetanyl)-
CAS Number:
1254115-23-5
Molecular Formula:
C7H14N2O
Molecular Weight:
142.1989
MDL Number:
MFCD21847918
IUPAC Name:
1-(oxetan-3-yl)piperazine
InChI:
InChI=1S/C7H14N2O/c1-3-9(4-2-8-1)7-5-10-6-7/h7-8H,1-6H2
InChI Key:
AOYSLJHKVBSXRU-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)C1COC1
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.111g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
142.202g/mol
Monoisotopic Mass:
142.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
24.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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