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

1-Cyclopropyl-5-oxopyrrolidine-3-carboxylic acid

CAS No.:
876716-43-7
Catalog Number:
AG004O05
Molecular Formula:
C8H11NO3
Molecular Weight:
169.1778
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$358
- +
5g
95%
In Stock USA
United States
$1136
- +
Product Description
Catalog Number:
AG004O05
Chemical Name:
1-Cyclopropyl-5-oxopyrrolidine-3-carboxylic acid
CAS Number:
876716-43-7
Molecular Formula:
C8H11NO3
Molecular Weight:
169.1778
MDL Number:
MFCD11040202
IUPAC Name:
1-cyclopropyl-5-oxopyrrolidine-3-carboxylic acid
InChI:
InChI=1S/C8H11NO3/c10-7-3-5(8(11)12)4-9(7)6-1-2-6/h5-6H,1-4H2,(H,11,12)
InChI Key:
AJVZAQNEJHXULB-UHFFFAOYSA-N
SMILES:
OC(=O)C1CN(C(=O)C1)C1CC1
Properties
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.074g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
169.18g/mol
Monoisotopic Mass:
169.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties