Home Carboxys 2-[(2-carboxyethyl)amino]butanedioic acid

2-[(2-carboxyethyl)amino]butanedioic acid

CAS No.:
153352-57-9
Catalog Number:
AG01BD9X
Molecular Formula:
C7H11NO6
Molecular Weight:
205.1653
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Product Description
Catalog Number:
AG01BD9X
Chemical Name:
2-[(2-carboxyethyl)amino]butanedioic acid
CAS Number:
153352-57-9
Molecular Formula:
C7H11NO6
Molecular Weight:
205.1653
MDL Number:
MFCD00185541
IUPAC Name:
2-(2-carboxyethylamino)butanedioic acid
InChI:
InChI=1S/C7H11NO6/c9-5(10)1-2-8-4(7(13)14)3-6(11)12/h4,8H,1-3H2,(H,9,10)(H,11,12)(H,13,14)
InChI Key:
AINPCLWBWFSAQV-UHFFFAOYSA-N
SMILES:
OC(=O)CCNC(C(=O)O)CC(=O)O
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.059g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
205.166g/mol
Monoisotopic Mass:
205.059g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.9  
Properties