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Home Carboxys 2-Oxo-1-oxaspiro[4.4]nonane-4-carboxylic acid

2-Oxo-1-oxaspiro[4.4]nonane-4-carboxylic acid

CAS No.:
18363-10-5
Catalog Number:
AG0027SP
Molecular Formula:
C9H12O4
Molecular Weight:
184.1892
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG0027SP
Chemical Name:
2-Oxo-1-oxaspiro[4.4]nonane-4-carboxylic acid
CAS Number:
18363-10-5
Molecular Formula:
C9H12O4
Molecular Weight:
184.1892
MDL Number:
MFCD00461592
IUPAC Name:
2-oxo-1-oxaspiro[4.4]nonane-4-carboxylic acid
InChI:
InChI=1S/C9H12O4/c10-7-5-6(8(11)12)9(13-7)3-1-2-4-9/h6H,1-5H2,(H,11,12)
InChI Key:
RHSJEQPXBBAWME-UHFFFAOYSA-N
SMILES:
O=C1CC(C2(O1)CCCC2)C(=O)O
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.074g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.191g/mol
Monoisotopic Mass:
184.074g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties