Home Carboxys 4-amino-6-(morpholin-4-yl)-1,3,5-triazine-2-carboxylic acid

4-amino-6-(morpholin-4-yl)-1,3,5-triazine-2-carboxylic acid

CAS No.:
46702-10-7
Catalog Number:
AG01BBJ3
Molecular Formula:
C8H11N5O3
Molecular Weight:
225.2046
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Product Description
Catalog Number:
AG01BBJ3
Chemical Name:
4-amino-6-(morpholin-4-yl)-1,3,5-triazine-2-carboxylic acid
CAS Number:
46702-10-7
Molecular Formula:
C8H11N5O3
Molecular Weight:
225.2046
MDL Number:
MFCD28954082
IUPAC Name:
4-amino-6-morpholin-4-yl-1,3,5-triazine-2-carboxylic acid
InChI:
InChI=1S/C8H11N5O3/c9-7-10-5(6(14)15)11-8(12-7)13-1-3-16-4-2-13/h1-4H2,(H,14,15)(H2,9,10,11,12)
InChI Key:
AJMUXQATAZCFEG-UHFFFAOYSA-N
SMILES:
Nc1nc(nc(n1)C(=O)O)N1CCOCC1
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.086g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
225.208g/mol
Monoisotopic Mass:
225.086g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties