Home Carboxys tert-Butyl 2,6-diazaspiro[3.4]octane-6-carboxylate oxalate(2:1)

tert-Butyl 2,6-diazaspiro[3.4]octane-6-carboxylate oxalate(2:1)

CAS No.:
1523618-25-8
Catalog Number:
AG00HY1G
Molecular Formula:
C24H42N4O8
Molecular Weight:
514.6123
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Product Description
Catalog Number:
AG00HY1G
Chemical Name:
tert-Butyl 2,6-diazaspiro[3.4]octane-6-carboxylate oxalate(2:1)
CAS Number:
1523618-25-8
Molecular Formula:
C24H42N4O8
Molecular Weight:
514.6123
IUPAC Name:
tert-butyl 2,6-diazaspiro[3.4]octane-6-carboxylate;oxalic acid
InChI:
InChI=1S/2C11H20N2O2.C2H2O4/c2*1-10(2,3)15-9(14)13-5-4-11(8-13)6-12-7-11;3-1(4)2(5)6/h2*12H,4-8H2,1-3H3;(H,3,4)(H,5,6)
InChI Key:
LFEWKQXWSHXJNQ-UHFFFAOYSA-N
SMILES:
O=C(N1CCC2(C1)CNC2)OC(C)(C)C.O=C(N1CCC2(C1)CNC2)OC(C)(C)C.OC(=O)C(=O)O
Properties
Complexity:
338  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
514.3g/mol
Formal Charge:
0
Heavy Atom Count:
36  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
514.62g/mol
Monoisotopic Mass:
514.3g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
158A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties