Home Carboxys tert-butyl 4-amino-11-azatricyclo[6.2.1.0,2,7]undeca-2,4,6-triene-11-carboxylate

tert-butyl 4-amino-11-azatricyclo[6.2.1.0,2,7]undeca-2,4,6-triene-11-carboxylate

CAS No.:
942492-11-7
Catalog Number:
AG01BUOO
Molecular Formula:
C15H20N2O2
Molecular Weight:
260.3315
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Product Description
Catalog Number:
AG01BUOO
Chemical Name:
tert-butyl 4-amino-11-azatricyclo[6.2.1.0,2,7]undeca-2,4,6-triene-11-carboxylate
CAS Number:
942492-11-7
Molecular Formula:
C15H20N2O2
Molecular Weight:
260.3315
MDL Number:
MFCD22665846
IUPAC Name:
tert-butyl 4-amino-11-azatricyclo[6.2.1.02,7]undeca-2(7),3,5-triene-11-carboxylate
InChI:
InChI=1S/C15H20N2O2/c1-15(2,3)19-14(18)17-12-6-7-13(17)11-8-9(16)4-5-10(11)12/h4-5,8,12-13H,6-7,16H2,1-3H3
InChI Key:
RGNQFMYCOUARHV-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)C1CCC2N1C(=O)OC(C)(C)C
Properties
Complexity:
377  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.152g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
260.337g/mol
Monoisotopic Mass:
260.152g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties