sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys 1-(4-Methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid

1-(4-Methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid

CAS No.:
56617-47-1
Catalog Number:
AG00E9T3
Molecular Formula:
C12H13NO4
Molecular Weight:
235.2359
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$57
- +
5g
97%
In Stock USA
United States
$225
- +
10g
97%
In Stock USA
United States
$400
- +
25g
97%
In Stock USA
United States
$800
- +
Product Description
Catalog Number:
AG00E9T3
Chemical Name:
1-(4-Methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid
CAS Number:
56617-47-1
Molecular Formula:
C12H13NO4
Molecular Weight:
235.2359
MDL Number:
MFCD00227562
IUPAC Name:
1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid
InChI:
InChI=1S/C12H13NO4/c1-17-10-4-2-9(3-5-10)13-7-8(12(15)16)6-11(13)14/h2-5,8H,6-7H2,1H3,(H,15,16)
InChI Key:
JIKAEHOGWAHVIJ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)N1CC(CC1=O)C(=O)O
Properties
Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.084g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.239g/mol
Monoisotopic Mass:
235.084g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Literature
Title Journal
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