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Home Carboxys Triethyl 1,3,5-triazine-2,4,6-tricarboxylate

Triethyl 1,3,5-triazine-2,4,6-tricarboxylate

CAS No.:
898-22-6
Catalog Number:
AG003Z31
Molecular Formula:
C12H15N3O6
Molecular Weight:
297.2640
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$100
- +
5g
95%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG003Z31
Chemical Name:
Triethyl 1,3,5-triazine-2,4,6-tricarboxylate
CAS Number:
898-22-6
Molecular Formula:
C12H15N3O6
Molecular Weight:
297.2640
MDL Number:
MFCD01419268
IUPAC Name:
triethyl 1,3,5-triazine-2,4,6-tricarboxylate
InChI:
InChI=1S/C12H15N3O6/c1-4-19-10(16)7-13-8(11(17)20-5-2)15-9(14-7)12(18)21-6-3/h4-6H2,1-3H3
InChI Key:
LKNPNZKIOSOWES-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nc(nc(n1)C(=O)OCC)C(=O)OCC
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.096g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.267g/mol
Monoisotopic Mass:
297.096g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Molecular versus crystal symmetry in tri-substituted triazine, benzene and isocyanurate derivatives. Acta crystallographica. Section B, Structural science 20061001
Properties