Home Carboxys 1-(Anilinocarbonyl)pyrrolidine-2-carboxylic acid

1-(Anilinocarbonyl)pyrrolidine-2-carboxylic acid

CAS No.:
827612-77-1
Catalog Number:
AG008IP6
Molecular Formula:
C12H14N2O3
Molecular Weight:
234.2512
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
500mg
95%
In Stock USA
United States
$182
- +
1g
95%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG008IP6
Chemical Name:
1-(Anilinocarbonyl)pyrrolidine-2-carboxylic acid
CAS Number:
827612-77-1
Molecular Formula:
C12H14N2O3
Molecular Weight:
234.2512
MDL Number:
MFCD00731596
IUPAC Name:
(2S)-1-(phenylcarbamoyl)pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C12H14N2O3/c15-11(16)10-7-4-8-14(10)12(17)13-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2,(H,13,17)(H,15,16)/t10-/m0/s1
InChI Key:
ZEEAHHXBZHTCOI-JTQLQIEISA-N
SMILES:
OC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1
Properties
Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
234.1g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
234.255g/mol
Monoisotopic Mass:
234.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties