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1403767-01-0 | 2,5-Diazabicyclo[2.2.2]octane-2-ethanol, β,β-dimethyl-
CAS No: 1403767-01-0 Catalog No: AG001CAQ MDL No:
Product Description
Catalog Number:
AG001CAQ
Chemical Name:
2,5-Diazabicyclo[2.2.2]octane-2-ethanol, β,β-dimethyl-
CAS Number:
1403767-01-0
Molecular Formula:
C10H20N2O
Molecular Weight:
184.2786
IUPAC Name:
2-(2,5-diazabicyclo[2.2.2]octan-2-yl)-2-methylpropan-1-ol
InChI:
InChI=1S/C10H20N2O/c1-10(2,7-13)12-6-8-3-4-9(12)5-11-8/h8-9,11,13H,3-7H2,1-2H3
InChI Key:
VOAYZFCNFPAWIP-UHFFFAOYSA-N
SMILES:
OCC(N1CC2CCC1CN2)(C)C
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.158g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
184.283g/mol
Monoisotopic Mass:
184.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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