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Home Carboxys 1-Isobutyl-5-oxopyrrolidine-3-carboxylic acid

1-Isobutyl-5-oxopyrrolidine-3-carboxylic acid

CAS No.:
773865-07-9
Catalog Number:
AG005MZU
Molecular Formula:
C9H15NO3
Molecular Weight:
185.2203
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:
AG005MZU
Chemical Name:
1-Isobutyl-5-oxopyrrolidine-3-carboxylic acid
CAS Number:
773865-07-9
Molecular Formula:
C9H15NO3
Molecular Weight:
185.2203
MDL Number:
MFCD04989714
IUPAC Name:
1-(2-methylpropyl)-5-oxopyrrolidine-3-carboxylic acid
InChI:
InChI=1S/C9H15NO3/c1-6(2)4-10-5-7(9(12)13)3-8(10)11/h6-7H,3-5H2,1-2H3,(H,12,13)
InChI Key:
YWZWNDCJUFFVLP-UHFFFAOYSA-N
SMILES:
CC(CN1CC(CC1=O)C(=O)O)C
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.105g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
185.223g/mol
Monoisotopic Mass:
185.105g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
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