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Home Carboxys 1-(2-Methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid

1-(2-Methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid

CAS No.:
39629-90-8
Catalog Number:
AG00C8AU
Molecular Formula:
C12H13NO4
Molecular Weight:
235.2359
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$62
- +
5g
95%
In Stock USA
United States
$150
- +
10g
95%
In Stock USA
United States
$225
- +
25g
95%
In Stock USA
United States
$325
- +
100g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00C8AU
Chemical Name:
1-(2-Methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid
CAS Number:
39629-90-8
Molecular Formula:
C12H13NO4
Molecular Weight:
235.2359
MDL Number:
MFCD03724918
IUPAC Name:
1-(2-methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid
InChI:
InChI=1S/C12H13NO4/c1-17-10-5-3-2-4-9(10)13-7-8(12(15)16)6-11(13)14/h2-5,8H,6-7H2,1H3,(H,15,16)
InChI Key:
BQQBMILQUDEPIK-UHFFFAOYSA-N
SMILES:
COc1ccccc1N1CC(CC1=O)C(=O)O
Properties
Complexity:
318  
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  
Properties