Home Other Building Blocks 5-Oxa-2-azaspiro[3.5]nonane oxalate(2:1)

5-Oxa-2-azaspiro[3.5]nonane oxalate(2:1)

CAS No.:
1523571-01-8
Catalog Number:
AG003AJU
Molecular Formula:
C16H28N2O6
Molecular Weight:
344.4033
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Product Description
Catalog Number:
AG003AJU
Chemical Name:
5-Oxa-2-azaspiro[3.5]nonane oxalate(2:1)
CAS Number:
1523571-01-8
Molecular Formula:
C16H28N2O6
Molecular Weight:
344.4033
MDL Number:
MFCD00153167
IUPAC Name:
5-oxa-2-azaspiro[3.5]nonane;oxalic acid
InChI:
InChI=1S/2C7H13NO.C2H2O4/c2*1-2-4-9-7(3-1)5-8-6-7;3-1(4)2(5)6/h2*8H,1-6H2;(H,3,4)(H,5,6)
InChI Key:
ZDVHRQSWICZLCY-UHFFFAOYSA-N
SMILES:
C1CCC2(OC1)CNC2.C1CCC2(OC1)CNC2.OC(=O)C(=O)O
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.195g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
344.408g/mol
Monoisotopic Mass:
344.195g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties