Home Carboxys 8-oxo-7-azaspiro[3.5]nonane-5-carboxylic acid

8-oxo-7-azaspiro[3.5]nonane-5-carboxylic acid

CAS No.:
2098142-54-0
Catalog Number:
AG01EKN1
Molecular Formula:
C9H13NO3
Molecular Weight:
183.2044
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Product Description
Catalog Number:
AG01EKN1
Chemical Name:
8-oxo-7-azaspiro[3.5]nonane-5-carboxylic acid
CAS Number:
2098142-54-0
Molecular Formula:
C9H13NO3
Molecular Weight:
183.2044
MDL Number:
MFCD30494963
IUPAC Name:
6-oxo-7-azaspiro[3.5]nonane-9-carboxylic acid
InChI:
InChI=1S/C9H13NO3/c11-7-4-9(2-1-3-9)6(5-10-7)8(12)13/h6H,1-5H2,(H,10,11)(H,12,13)
InChI Key:
SCCKXDGLPPPUJF-UHFFFAOYSA-N
SMILES:
O=C1NCC(C2(C1)CCC2)C(=O)O
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.09g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
183.207g/mol
Monoisotopic Mass:
183.09g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties