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83540-64-1 | 2H-1,4,6-Oxadiazocin-5(6H)-one, 4,6-diethyltetrahydro-
CAS No: 83540-64-1 Catalog No: AG0058K8 MDL No:
Product Description
Catalog Number:
AG0058K8
Chemical Name:
2H-1,4,6-Oxadiazocin-5(6H)-one, 4,6-diethyltetrahydro-
CAS Number:
83540-64-1
Molecular Formula:
C9H18N2O2
Molecular Weight:
186.2514
IUPAC Name:
4,6-diethyl-1,4,6-oxadiazocan-5-one
InChI:
InChI=1S/C9H18N2O2/c1-3-10-5-7-13-8-6-11(4-2)9(10)12/h3-8H2,1-2H3
InChI Key:
ISZWKEFEEHGSJE-UHFFFAOYSA-N
SMILES:
CCN1CCOCCN(C1=O)CC
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.137g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.255g/mol
Monoisotopic Mass:
186.137g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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