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169209-63-6

169209-63-6 | 2,4-Pyrrolidinedicarboxylic acid, 4-amino-, (2R,4R)-

CAS No: 169209-63-6 Catalog No: AG001YL5 MDL No:

Product Description

Catalog Number:
AG001YL5
Chemical Name:
2,4-Pyrrolidinedicarboxylic acid, 4-amino-, (2R,4R)-
CAS Number:
169209-63-6
Molecular Formula:
C6H10N2O4
Molecular Weight:
174.1546
IUPAC Name:
(2R,4R)-4-aminopyrrolidine-2,4-dicarboxylic acid
InChI:
InChI=1S/C6H10N2O4/c7-6(5(11)12)1-3(4(9)10)8-2-6/h3,8H,1-2,7H2,(H,9,10)(H,11,12)/t3-,6-/m1/s1
InChI Key:
XZFMJVJDSYRWDQ-AWFVSMACSA-N
SMILES:
OC(=O)[C@@H]1NC[C@@](C1)(N)C(=O)O

Properties

Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
174.064g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
174.156g/mol
Monoisotopic Mass:
174.064g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-6.5  

Literature

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