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Home > Other Heterocycles > 2060052-48-2
2060052-48-2 | 1-({2-oxabicyclo[2.1.1]hexan-1-yl}methyl)piperazine
CAS No: 2060052-48-2 Catalog No: AG01BYKS MDL No:MFCD30486980
Product Description
Catalog Number:
AG01BYKS
Chemical Name:
1-({2-oxabicyclo[2.1.1]hexan-1-yl}methyl)piperazine
CAS Number:
2060052-48-2
Molecular Formula:
C10H18N2O
Molecular Weight:
182.2627
MDL Number:
MFCD30486980
IUPAC Name:
1-(2-oxabicyclo[2.1.1]hexan-1-ylmethyl)piperazine
InChI:
InChI=1S/C10H18N2O/c1-3-12(4-2-11-1)8-10-5-9(6-10)7-13-10/h9,11H,1-8H2
InChI Key:
ABDMFDMDRFWRTM-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)CC12OCC(C1)C2
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.142g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.267g/mol
Monoisotopic Mass:
182.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
24.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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