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7282-71-5 | 10-methyl-10-azatricyclo[4.3.1.12,5]undecan-8-one
CAS No: 7282-71-5 Catalog No: AG005EK4 MDL No:
Product Description
Catalog Number:
AG005EK4
Chemical Name:
10-methyl-10-azatricyclo[4.3.1.12,5]undecan-8-one
CAS Number:
7282-71-5
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
IUPAC Name:
10-methyl-10-azatricyclo[4.3.1.12,5]undecan-8-one
InChI:
InChI=1S/C11H17NO/c1-12-10-5-9(13)6-11(12)8-3-2-7(10)4-8/h7-8,10-11H,2-6H2,1H3
InChI Key:
DUINGRBTGMDCEY-UHFFFAOYSA-N
SMILES:
O=C1CC2C3CCC(C(C1)N2C)C3
NSC Number:
135469
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.263g/mol
Monoisotopic Mass:
179.131g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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