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Home > Other Heterocycles > 96131-19-0
96131-19-0 | 3-BUTYL-8-METHYL-3,8-DIAZABICYCLO[3.2.1]OCTANE
CAS No: 96131-19-0 Catalog No: AG006SQE MDL No:
Product Description
Catalog Number:
AG006SQE
Chemical Name:
3-BUTYL-8-METHYL-3,8-DIAZABICYCLO[3.2.1]OCTANE
CAS Number:
96131-19-0
Molecular Formula:
C11H22N2
Molecular Weight:
182.3058
IUPAC Name:
3-butyl-8-methyl-3,8-diazabicyclo[3.2.1]octane
InChI:
InChI=1S/C11H22N2/c1-3-4-7-13-8-10-5-6-11(9-13)12(10)2/h10-11H,3-9H2,1-2H3
InChI Key:
FGZMZZHXJRBCDF-UHFFFAOYSA-N
SMILES:
CCCCN1CC2CCC(C1)N2C
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.178g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.311g/mol
Monoisotopic Mass:
182.178g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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