Home Other Building Blocks 1,4-Dioxa-8-azaspiro[4.5]decane-6-methanamine, ethanedioate (2:1)

1,4-Dioxa-8-azaspiro[4.5]decane-6-methanamine, ethanedioate (2:1)

CAS No.:
2007925-01-9
Catalog Number:
AG002D01
Molecular Formula:
C18H34N4O8
Molecular Weight:
434.4846
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Product Description
Catalog Number:
AG002D01
Chemical Name:
1,4-Dioxa-8-azaspiro[4.5]decane-6-methanamine, ethanedioate (2:1)
CAS Number:
2007925-01-9
Molecular Formula:
C18H34N4O8
Molecular Weight:
434.4846
IUPAC Name:
1,4-dioxa-8-azaspiro[4.5]decan-6-ylmethanamine;oxalic acid
InChI:
InChI=1S/2C8H16N2O2.C2H2O4/c2*9-5-7-6-10-2-1-8(7)11-3-4-12-8;3-1(4)2(5)6/h2*7,10H,1-6,9H2;(H,3,4)(H,5,6)
InChI Key:
FTTJMCDJDSQILG-UHFFFAOYSA-N
SMILES:
OC(=O)C(=O)O.NCC1CNCCC21OCCO2.NCC1CNCCC21OCCO2
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
434.238g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
434.49g/mol
Monoisotopic Mass:
434.238g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
188A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties