Home Carboxys tert-butyl 7-benzyl-1,7-diazaspiro[4.5]decane-1-carboxylate oxalate

tert-butyl 7-benzyl-1,7-diazaspiro[4.5]decane-1-carboxylate oxalate

CAS No.:
1415560-12-1
Catalog Number:
AG009CF3
Molecular Formula:
C22H32N2O6
Molecular Weight:
420.4993
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Product Description
Catalog Number:
AG009CF3
Chemical Name:
tert-butyl 7-benzyl-1,7-diazaspiro[4.5]decane-1-carboxylate oxalate
CAS Number:
1415560-12-1
Molecular Formula:
C22H32N2O6
Molecular Weight:
420.4993
MDL Number:
MFCD19443212
IUPAC Name:
tert-butyl 9-benzyl-1,9-diazaspiro[4.5]decane-1-carboxylate;oxalic acid
InChI:
InChI=1S/C20H30N2O2.C2H2O4/c1-19(2,3)24-18(23)22-14-8-12-20(22)11-7-13-21(16-20)15-17-9-5-4-6-10-17;3-1(4)2(5)6/h4-6,9-10H,7-8,11-16H2,1-3H3;(H,3,4)(H,5,6)
InChI Key:
NMAYXQGLBMIQJJ-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC21CCCN(C2)Cc1ccccc1)OC(C)(C)C.OC(=O)C(=O)O
Properties
Complexity:
511  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
420.226g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
420.506g/mol
Monoisotopic Mass:
420.226g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties