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Pyrrolidine-3-carboxylic acid

CAS No.:
59378-87-9
Catalog Number:
AG003JWD
Molecular Formula:
C5H9NO2
Molecular Weight:
115.1305
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$44
- +
5g
98%
In Stock USA
United States
$132
- +
10g
98%
In Stock USA
United States
$225
- +
25g
98%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG003JWD
Chemical Name:
Pyrrolidine-3-carboxylic acid
CAS Number:
59378-87-9
Molecular Formula:
C5H9NO2
Molecular Weight:
115.1305
MDL Number:
MFCD01318699
IUPAC Name:
pyrrolidine-3-carboxylic acid
InChI:
InChI=1S/C5H9NO2/c7-5(8)4-1-2-6-3-4/h4,6H,1-3H2,(H,7,8)
InChI Key:
JAEIBKXSIXOLOL-UHFFFAOYSA-N
SMILES:
OC(=O)C1CNCC1
Properties
Complexity:
103  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
115.063g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
115.132g/mol
Monoisotopic Mass:
115.063g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.2  
Literature
Title Journal
Catalysis of 3-pyrrolidinecarboxylic acid and related pyrrolidine derivatives in enantioselective anti-Mannich-type reactions: importance of the 3-acid group on pyrrolidine for stereocontrol. Journal of the American Chemical Society 20080123
3-Pyrrolidinecarboxylic acid for direct catalytic asymmetric anti-Mannich-type reactions of unmodified ketones. Journal of the American Chemical Society 20060802
An efficient route to either enantiomer of orthogonally protected trans-3-aminopyrrolidine-4-carboxylic acid. The Journal of organic chemistry 20010518
Properties